Trichloromethane (CAS 67-66-3)
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Trichloromethane. CAS 67-66-3.
Free, and generated automatically from the sources listed on this page. No person has reviewed it, and it describes the substance in general — not your material, your process or your intended market.
Section 9 — physicochemical properties: 10 of 22 established.
We show what is established and name what is not. Classification and identity are complete on every card; section 9 is where public data is thin.
Identity, structure, physical and chemical properties, analytical data and the literature — every value with the source it came from and the date that source was read. The full record is in the data sections further down this page.
- Identity CAS · EC · IUPAC · synonyms · molecular formula · molecular weight
- Structure 2D · 3D · SMILES · InChI · InChIKey
- Physical melting point · boiling point · density · vapour pressure · solubility
- Chemical reactivity · stability · incompatible materials
- Analytical spectra and methods where available
- References literature, with DOI where a DOI exists
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Données transcrites à partir de registres réglementaires et de la littérature spécialisée, avec indication de la source et de l'édition. Elles ne remplacent pas la fiche de données de sécurité du fournisseur. Les champs sans source enregistrée sont signalés comme tels.
📊 Données physicochimiques — CAS 67-66-3
Propriétés physicochimiques
Aperçu rapide
Propriétés détaillées
Uzupełnienie tabeli „Physicochemical properties (baza danych)” poniżej — powtórzone wartości pokazujemy tylko raz.
| Propriété | Valeur | Unité | Conditions | Source |
|---|---|---|---|---|
| Indice de réfraction (nD) | 1.4459[1] | 20 °C, D-line | Reid, Prausnitz, Poling 4th ed. (1987) |
🔬 Propriétés avancées
Identifiants chimiques
C(Cl)(Cl)Cl Sources de données : Reid, Prausnitz, Poling 4th ed. (1987) (ISBN 9780070517998)
Dernière mise à jour : 2026-09-02
📚 Références scientifiques (Chicago Author-Date) (1 sources)
- PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. ↗ dotyczy: Indice de réfraction (nD)
Aperçu chimique: Chloroform
| Formule brute | CHCl3[1] |
| Masse moléculaire | 119.37 g/mol[1] |
| Point de fusion | -63.5 °C[1][2] |
| Point d'ébullition | 61.15 °C (760 mmHg)[1][2] |
| Densité | 1.4832 g/cm³[1] |
| LogP (lipophilie) | 1.97[1] |
| Nom IUPAC | chloroform[1] |
| SMILES | C(Cl)(Cl)Cl[1] |
| InChIKey | HEDRZPFGACZZDS-UHFFFAOYSA-N[1] |
Synonymes: CHLOROFORM · Trichloromethane · 67-66-3 · Trichlormethan · Trichloroform
Sources de données : PubChem (NLM/NIH), Reid, Prausnitz, Poling 4th ed. (1987)
Dernière mise à jour : 2026-08-25
📚 Références scientifiques (Chicago Author-Date) (2 sources)
- PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. ↗ dotyczy: Formule brute · Masse moléculaire · Point de fusion · Point d'ébullition · Densité · LogP (lipophilie) · Nom IUPAC · SMILES · InChIKey
- NIST. Chemistry WebBook, SRD 69. National Institute of Standards and Technology. ↗ dotyczy: Point de fusion · Point d'ébullition
RECHERCHE SCIENTIFIQUE
📚 Références scientifiques (Chicago Author-Date) 20 refs · 5 baz
MOLECULE Bibliographie par CAS (en direct depuis 13+ bases de données)
Sources : db:Europe PMC (10) · db:arxiv (2) · db:openalex (6) · db:crossref (1) · db:molgod_data_citations:crossref (1)
- db:Europe PMC et al.. (2026). "Safety Assessment of Pseudomonas fluorescens DS17R Chloroform Extract: Low Acute But Dose-Dependent Subacute Oral Toxicity in Rats.". https://doi.org/10.1155/jt/8893441 →
- db:Europe PMC et al.. (2026). "Unveiling the anti-inflammatory activity of chloroform fraction of curcuma wallichii and its phytoconstituents by in vivo and in silico studies.". https://doi.org/10.1038/s41598-025-28248-3 →
- db:Europe PMC et al.. (2026). "In silico anticancer, antioxidant and anti-inflammatory study on GC-MS-based profiling of chloroform and hexane extracts of Erigeron multiradiatus.". https://doi.org/10.1007/s40203-026-00645-0 →
- db:Europe PMC et al.. (2026). "Computational and Experimental Analysis of Sophora alopecuroides L. Chloroform Fraction: Active Components and Anti-Breast Cancer Resistance Mechanisms.". https://doi.org/10.3390/molecules31040660 →
- db:Europe PMC (2026). "Chloroform Toxicity".
- db:arxiv Anirban Polley. (2026). "Concentration-Dependent Membrane Destabilization in DPPC Bilayers: Distinct Insertion Mechanisms and Stress Redistribution by Chloroform and Alkanols". arXiv (2605.08780v1).
- db:Europe PMC (2025). "Chloroform: MAK Value Documentation, addendum - Translation of the German version from 2022.". https://doi.org/10.34865/mb6766e10_1ad →
- db:Europe PMC et al.. (2025). "Towards sustainable lipidomics: computational screening and experimental validation of chloroform-free alternatives for lipid extraction.". https://doi.org/10.1007/s00216-025-06136-z →
- db:Europe PMC (2025). "Conformational Evolution of Bicalutamide in Chloroform: A Comprehensive NMR Study.". https://doi.org/10.3390/molecules30224479 →
- db:Europe PMC (2025). "Modeling reveals a metabolic basis of competition among Dehalobacter strains during tandem chloroform and dichloromethane metabolism.". https://doi.org/10.1128/msystems.00847-25 →
- db:Europe PMC et al.. (2025). "Chloroform exposure and risk of leukemia: systematic review and meta-analysis.". https://doi.org/10.3389/fpubh.2025.1491075 →
- db:arxiv R. D. Nimantha Karunathilaka, Athige Rajith Niloshan Silva, Chathuranga Bharathee Ranaweera et al.. (2025). "In Vitro Antibacterial activity of hexane, Chloroform and methanolic extracts of different parts of Acronychia pedunculata grown in Sri Lanka". arXiv (2506.13121v1). https://doi.org/10.21474/ijar01/1364 →
- db:openalex Clara Torrentó, Jordi Palau, Diana Rodríguez-Fernández et al.. (2017). "Carbon and Chlorine Isotope Fractionation Patterns Associated with Different Engineered Chloroform Transformation Reactions". Environmental Science & Technology. https://doi.org/10.1021/acs.est.7b00679 →
- db:crossref (2014). "Phenol/chloroform extraction v1". https://doi.org/10.17504/protocols.io.cdts6m →
- db:openalex Joel Åkesson, Oskar Sundborg, Olof Wahlström et al.. (2012). "A van der Waals density functional study of chloroform and other trihalomethanes on graphene". The Journal of Chemical Physics. https://doi.org/10.1063/1.4764356 →
- db:openalex Michael A. Lyons, Raymond S. H. Yang, Arthur N. Mayeno et al.. (2008). "Computational Toxicology of Chloroform: Reverse Dosimetry Using Bayesian Inference, Markov Chain Monte Carlo Simulation, and Human Biomonitoring Data". Environmental Health Perspectives. https://doi.org/10.1289/ehp.11079 →
- db:molgod_data_citations:crossref (2004). "Chloroform 67-66-3.". https://doi.org/10.1002/0471701343.sdp05774 →
- db:openalex M.D. Reuber. (1979). "Carcinogenicity of chloroform.". Environmental Health Perspectives. https://doi.org/10.1289/ehp.7931171 →
- db:openalex (1976). "Report on the Carcinogenesis Bioassay of Chloroform (CAS No. 67-66-3).". PubMed.
- db:openalex John A. Secrist, Marshall W. Logue. (1972). "Amine hydrochlorides by reduction in the presence of chloroform". The Journal of Organic Chemistry. https://doi.org/10.1021/jo00967a042 →
📡 Spectroscopie — CAS 67-66-3
Guide de contrôle de la pureté Contrôle qualité
Vérifiez la pureté du réactif à l'aide de méthodes analytiques normalisées. Sélectionnez une méthode d'essai ci-dessous et saisissez vos résultats de mesure pour un calcul automatisé.
🛡️ Sécurité — CAS 67-66-3
Classification GHS/CLP — Règlement (CE) n° 1272/2008 + UN GHS Rev. 9 (2021).
🚨 Mentions de danger (H)
- H351 — Susceptible de provoquer le cancer.
- H361d — Susceptible de nuire au fœtus.
- H331 — Toxique par inhalation.
- H302 — Nocif en cas d'ingestion.
- H372 — Risque avéré d'effets graves pour les organes à la suite d'expositions répétées ou d'une exposition prolongée.
- H315 — Provoque une irritation cutanée.
- H319 — Provoque une sévère irritation des yeux.
🛡 Conseils de prudence (P)
- P203 — Se procurer, lire et suivre toutes les instructions de sécurité avant l’utilisation.
- P261 — Éviter de respirer les poussières/fumées/gaz/brouillards/vapeurs/aérosols.
- P273 — Éviter le rejet dans l'environnement.
✓ Classification harmonisée conformément à l'annexe VI du règlement CLP (CE) 1272/2008 (classification officielle, contraignante). Numéro d'index : 602-006-00-4.
Référence (Chicago) : European Chemicals Agency. "chloroform; trichloromethane, Index No. 602-006-00-4." In Table 3 of Annex VI to Regulation (EC) No 1272/2008 (CLP Regulation), 23rd Adaptation to Technical Progress (harmonised list as of 2026-07-07). Helsinki: European Chemicals Agency, 2026. https://echa.europa.eu/information-on-chemicals/annex-vi-to-clp.
Traductions : Règlement CLP (CE) 1272/2008, Annexe III et IV. Données : PubChem/NLM.
📚 Références scientifiques consolidées — Chicago auteur-date 10 sources
Références collectées dans tous les onglets du Safety Hub. CAS : 67-66-3 ·
PubChem ↗
- Parlament Europejski i Rada UE. 2008. "Rozporządzenie (WE) nr 1272/2008 w sprawie klasyfikacji, oznakowania i pakowania substancji (CLP)." Dz.Urz. UE L 353. [↗] GHS, Réglementations
- United Nations Economic Commission for Europe (UNECE). 2021. "Globally Harmonized System of Classification and Labelling of Chemicals (GHS), Ninth Revised Edition." United Nations, Geneva. [↗] GHS
- Goldfrank, Lewis R., Robert S. Hoffman, Mary Ann Howland, et al.. 2019. "Goldfrank's Toxicologic Emergencies, 11th ed.." McGraw-Hill Education, New York. ISBN 978-1-25-985961-8. Pierwsza pomoc, Toksykologia
- National Institute for Occupational Safety and Health (NIOSH). 2023. "NIOSH Pocket Guide to Chemical Hazards (DHHS Publ. 2005-149)." U.S. Department of Health and Human Services / CDC, Cincinnati, OH. [↗] Pierwsza pomoc, PPE, Toksykologia
- European Committee for Standardization (CEN). 2016. "EN 374-1:2016 — Protective gloves against dangerous chemicals and micro-organisms." CEN, Brussels. [↗] PPE
- UNECE. 2023. "European Agreement Concerning the International Carriage of Dangerous Goods by Road (ADR 2025)." United Nations, Geneva. [↗] Utylizacja, Regulacje
- National Fire Protection Association (NFPA). 2022. "NFPA 400 — Hazardous Materials Code." NFPA, Quincy, MA. [↗] Magazynowanie
- Urben, P.G. (ed.). 2017. "Bretherick's Handbook of Reactive Chemical Hazards, 8th ed.." Butterworth-Heinemann / Elsevier, Oxford. [↗] Magazynowanie
- Ministerstwo Klimatu i Środowiska RP. 2023. "Baza danych o produktach i opakowaniach oraz o gospodarce odpadami (BDO)." Ministerstwo Klimatu i Środowiska, Warszawa. [↗] Utylizacja
- International Agency for Research on Cancer (IARC / WHO). 2024. "IARC Monographs on the Identification of Carcinogenic Hazards to Humans — List of Classifications." WHO, Lyon. [↗] Toksykologia
Les onglets possédant leurs propres références (Emergency, PPE, Storage, Waste) contiennent des entrées bibliographiques supplémentaires au sein de leurs sections respectives.
Statistiques analytiques (test t · RSD · Grubbs · Q-Dixon) ICH Q2
Collez une série de mesures répétées (CSV ou un nombre par ligne). Le calculateur calculera la moyenne, l'écart-type, l'IC à 95 %, et détectera les valeurs aberrantes (Grubbs + Dixon Q).
📐 Formules statistiques
x̄ = Σxᵢ / n— moyenne arithmétiques² = Σ(xᵢ - x̄)² / (n-1)— variance de l'échantillons = √s²— écart-typeRSD% = (s / x̄) × 100%— écart-type relatifCI₉₅ = x̄ ± t(0.05, n-1) × s / √n— Student's tG = |xᵢ - x̄| / s— test de GrubbsQ = |xsuspect - xnearest| / |xmax - xmin|— Dixon Q-test
Source : ICH Q2(R2) Validation of Analytical Procedures · ICH PDF ↗
Calculateur de recettes de tampons UNIQUE
Choisissez un tampon dans la liste de 20 systèmes courants → saisissez le pH cible → vous obtiendrez une recette exacte avec les masses à peser.
Étape 1 : Choisissez un système tampon
📜 Historique des recettes (10 dernières)
Classification pour le transport (ADR / IATA / IMDG) UN 1888
🛣️ ADR Transport routier
- Classe:
- 6.1
- Groupe d'emballage:
- III
- Désignation d'expédition:
- Chloroform
Sources : ADR 2025 ↗ · IATA DGR ↗ · IMDG Code ↗
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Deskryptory Lipinskiego (struktura)
Conseiller de stabilité & durée de conservation Arrhenius
Saisissez les conditions de stockage → l'algorithme d'Arrhenius prédira la concentration restante, la demi-vie et une recommandation d'utilisation.
📐 Détails du calcul (Arrhenius + premier ordre)
Signes visuels de dégradation :
- Yellowing = phosgene formation
- Odor of phosgene (musty hay)
❄️ Recommandations de conservation
- Temperature:
- 2-8°C
- Light:
- Amber glass MANDATORY
- Stabilizers:
- Ethanol 0.5-1% or amylene
- Container:
- Glass only
- Incompatible:
- Bases, aluminum; forms phosgene on light/O₂ exposure
🧪 Assistant de préparation de solution (Smart Prep)
Saisissez ce que vous souhaitez préparer — je générerai un SOP
📚 Aperçu de la littérature scientifique — CAS 67-66-3
⭐ Principales découvertes (littérature scientifique) 20 publications
67-66-3
— multi-criteria ranking (W12): 30% citations · 20% actualité · 20% thème · 15% historique · 15% open access.
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#1Toshiyuki Sugimoto, Tomoya Kuwahara, Fengying Liang et al. (2022) · ACS OmegaPourquoi c'est important : Open access
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#2Clara Torrentó, Jordi Palau, Diana Rodríguez-Fernández et al. (2017) · Environmental Science & TechnologyPourquoi c'est important : Open access
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#3John A. Secrist, Marshall W. Logue (1972) · The Journal of Organic ChemistryPourquoi c'est important : Open access
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#4R. D. Nimantha Karunathilaka, Athige Rajith Niloshan Silva, Chathuranga Bharathee Ranaweera et al. (2025) · arXiv (2506.13121v1)Pourquoi c'est important : Récente (2025) · open access
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#5M.D. Reuber (1979) · Environmental Health PerspectivesPourquoi c'est important : Open access
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#6et al. (2025) · Analytical and Bioanalytical ChemistryPourquoi c'est important : Récente (2025) · open access
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#7Konstantin Belov; Ilya Khodov (2025) · MoleculesPourquoi c'est important : Récente (2025) · open access
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#8(2026)Pourquoi c'est important : Récente (2026) · open access
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#9Anirban Polley (2026) · arXiv (2605.08780v1)Pourquoi c'est important : Récente (2026) · open accessSCORE 7.85 Mécanisme Open Access
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#10Michael A. Lyons, Raymond S. H. Yang, Arthur N. Mayeno et al. (2008) · Environmental Health PerspectivesPourquoi c'est important : Open access
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#11Joel Åkesson, Oskar Sundborg, Olof Wahlström et al. (2012) · The Journal of Chemical PhysicsPourquoi c'est important : Open access
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#12et al. (2026) · MoleculesPourquoi c'est important : Récente (2026) · open access
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#13Olivia Bulka; Elizabeth A. Edwards; Radhakrishnan Mahadevan (2025) · mSystemsPourquoi c'est important : Récente (2025) · open access
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#14(2025)Pourquoi c'est important : Récente (2025) · open access
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#15et al. (2026) · Journal of ToxicologyPourquoi c'est important : Récente (2026) · open access
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#16et al. (2026) · Scientific ReportsPourquoi c'est important : Récente (2026) · open access
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#17et al. (2026) · In Silico PharmacologyPourquoi c'est important : Récente (2026) · open access
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#18et al. (2025) · Frontiers in Public HealthPourquoi c'est important : Récente (2025) · open access
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#19(2014)Pourquoi c'est important : Open access
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#20Report on the Carcinogenesis Bioassay of Chloroform (CAS No. 67-66-3).(1976) · PubMedPourquoi c'est important : Sélectionné par un score multicritère (citations + actualité + thème + historique + OA).SCORE 4.14 Analytique Citations: 12
Why this page can be checked
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Classification
Read against the harmonised entry where one exists, with the index number stated. Self-classification is shown separately and labelled.
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The Gap Report Guarantee
If the available evidence cannot support a defensible document for your CAS number and product specification, we will not invent the missing values. You receive a documented gap report and choose: a refund, store credit, or the report on its own.
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If a signed card is rejected by an authority or by a customer’s compliance officer on one of the points we checked and reported as passed, we re-issue it corrected at no charge and credit the original fee.
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Trichloromethane — CAS 67-66-3. Listed by Xilong Scientific. Prepared from the supplier’s public catalogue; not verified against their internal data.
📚 RÉFÉRENCES (Bibliographie agrégée, Chicago Author-Date) 79 éléments
Toutes les sources scientifiques citées dans les accordéons ci-dessus pour le CAS 67-66-3. Format : Chicago Manual of Style, 17e éd., système Auteur-Date.
🗄️ Bases de données scientifiques
- NIST. n.d. NIST Chemistry WebBook: CAS 67-66-3. Gaithersburg, MD: National Institute of Standards and Technology. https://webbook.nist.gov/cgi/cbook.cgi?ID=67-66-3.
- AIST. n.d. Spectral Database for Organic Compounds (SDBS): CAS 67-66-3. Tsukuba, Japan: National Institute of Advanced Industrial Science and Technology. https://sdbs.db.aist.go.jp/.
- Linstrom, Peter J., and William G. Mallard, eds. n.d. NIST Chemistry WebBook: NIST Standard Reference Database Number 69. Gaithersburg, MD: National Institute of Standards and Technology. https://doi.org/10.18434/T4D303.
- PubChem. n.d. PubChem Compound Summary: CAS 67-66-3. Bethesda, MD: National Center for Biotechnology Information (NCBI), National Library of Medicine. https://pubchem.ncbi.nlm.nih.gov/#query=67-66-3.
📐 Normes / Lignes directrices
- ICH. 2003. "Stability Testing of New Drug Substances and Products: Q1A(R2)." Geneva: International Council for Harmonisation of Technical Requirements for Pharmaceuticals for Human Use. https://database.ich.org/sites/default/files/Q1A%28R2%29%20Guideline.pdf.
- National Fire Protection Association (NFPA). 2024. "NFPA 30: Flammable and Combustible Liquids Code." NFPA, Quincy, MA. https://www.nfpa.org/codes-and-standards/all-codes-and-standards/list-of-codes-and-standards/detail?code=30.
- Occupational Safety and Health Administration (OSHA). 2023. "29 CFR 1910.106 — Flammable Liquids." U.S. Department of Labor, Federal Register. https://www.osha.gov/laws-regs/regulations/standardnumber/1910/1910.106.
- European Chemicals Agency (ECHA). 2024. "Annex VI to Regulation (EC) No 1272/2008 (CLP) — Harmonised Classification and Labelling." ECHA, Helsinki / Official Journal of the European Union. https://echa.europa.eu/regulations/clp/clp-classification.
- European Committee for Standardization (CEN). 2016. "EN 374-1:2016 — Protective gloves against dangerous chemicals and micro-organisms — Part 1: Terminology and performance requirements for chemical risks." CEN, Brussels. https://standards.cencenelec.eu/dyn/www/f?p=205:110:::::FSP_PROJECT,FSP_ORG_ID:38536,6080&cs=1B0DAA8B85DF42E4A2C70E5D71F0BFA32.
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📖 Livres
- Hansen, Charles M. 2007. Hansen Solubility Parameters: A User's Handbook, 2nd ed.. Boca Raton, FL: CRC Press. https://www.routledge.com/Hansen-Solubility-Parameters-A-Users-Handbook/Hansen/p/book/9780849372483.
- Barton, Allan F. M. 1991. CRC Handbook of Solubility Parameters and Other Cohesion Parameters: 2nd ed.. Boca Raton, FL: CRC Press. https://www.routledge.com/CRC-Handbook-of-Solubility-Parameters-and-Other-Cohesion-Parameters/Barton/p/book/9780849301766.
- Connors, Kenneth A., Gordon L. Amidon, and Valentino J. Stella. 1986. Chemical Stability of Pharmaceuticals: A Handbook for Pharmacists, 2nd ed.. New York: Wiley. https://doi.org/10.1002/0471734683.
- Rumble, John R., ed. 2019. CRC Handbook of Chemistry and Physics: 100th Edition. Boca Raton, FL: CRC Press. https://hbcp.chemnetbase.com/.
- Urben, Peter G. 2017. Bretherick's Handbook of Reactive Chemical Hazards, 8th Edition. Academic Press / Elsevier, Oxford. https://www.sciencedirect.com/book/9780081010594.
📘 Monographies
- IARC. n.d. IARC Monographs on the Identification of Carcinogenic Hazards to Humans: CAS 67-66-3. Lyon, France: International Agency for Research on Cancer, World Health Organization. https://monographs.iarc.who.int/list-of-classifications/.
📄 Articles scientifiques (évalués par les pairs)
- Stefanis, Emmanuel, and Costas Panayiotou. 2008. "Prediction of Hansen Solubility Parameters with a New Group-Contribution Method." International Journal of Thermophysics 29: 568-585. https://doi.org/10.1007/s10765-008-0415-z.
- Stoll, Vincent S., and John S. Blanchard. 1990. "Buffers: Principles and Practice: In Methods in Enzymology, vol. 182." San Diego: Academic Press. https://doi.org/10.1016/0076-6879(90)82008-P.
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