Dimethyl acetylenedicarboxylate (CAS 762-42-5)

Dimethyl acetylenedicarboxylate

CAS 762-42-5  ·  C6H6O4  ·  MW 142.11 g/mol

Caricamento molecola...
Modello 3D Dimethyl acetylenedicarboxylate, CAS 762-42-5, formula molecolare C6H6O4, massa molare 142.11 g/mol
Informazioni su Dimethyl acetylenedicarboxylate (CAS 762-42-5)

Dimethyl acetylenedicarboxylate (CAS 762-42-5) è un composto chimico registrato con il numero CAS 762-42-5, con formula bruta C6H6O4, e massa molare di 142.11 g/mol.

La molecola contiene 16 atomi collegati da 15 legami chimici. Il nome sistematico IUPAC completo di questo composto è dimethyl but-2-ynedioate. Il modello 3D interattivo qui sopra permette di visualizzare la disposizione spaziale degli atomi — puoi ruotarlo con il mouse, zoomare con la rotellina e passare tra le modalità di visualizzazione scheletro / Ball & Stick / Space Fill.

Dal punto di vista delle proprietà chimico-fisiche, il coefficiente di ripartizione logP = 0.8 (valore positivo, composto lipofilo), superficie polare PSA = 52.6 Ų, 0 donatori e 4 accettori di legami a idrogeno. Questi parametri sono fondamentali per valutare la biodisponibilità e l'interazione con le biomolecole.

I dati chimici di questo composto provengono da PubChem (NIH NLM NCBI), uno dei più grandi database chimici al mondo. Tutte le informazioni sono aggiornate automaticamente e arricchite con le traduzioni delle indicazioni di pericolo GHS conformi al Regolamento CLP (CE 1272/2008). Il widget qui sopra può essere utilizzato per scopi educativi, di ricerca e commerciali.

Proprietà chimico-fisiche
Wzór sumarycznyC6H6O4
Masa molowa142.11 g/mol
IUPACdimethyl but-2-ynedioate
SMILESCOC(=O)C#CC(=O)OC
InChIKeyVHILMKFSCRWWIJ-UHFFFAOYSA-N
logP (XLogP3)0.8
PSA52.6 Ų
HBD / HBA0 / 4
PubChem CIDCID 12980 ↗
Sicurezza GHS

Sygnał: Niebezpieczeństwo

GHS05
GHS05
GHS07
GHS07

H302 — Działa szkodliwie po połknięciu

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

Letteratura scientifica

Related literature

20 artykułów · 6 open access · Źródła: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Timeline publikacji (20 artykułów)

1954: 1 artykułów19541979: 1 artykułów1997: 1 artykułów2000: 1 artykułów2007: 1 artykułów2008: 1 artykułów2010: 1 artykułów2011: 1 artykułów2014: 1 artykułów20142015: 1 artykułów2018: 1 artykułów2019: 4 artykułów2021: 2 artykułów2022: 1 artykułów2023: 1 artykułów2025: 1 artykułów2025

Wysokość słupka = liczba artykułów w roku. Hover dla szczegółów.

R. Qiu (2019) · Acta Crystallographica. Section B: Structural Science, Crystal Engineering and Materials
AI Summary
The Crystal Growth for Beginners (3rd edition) by Ivan Markov is an excellent one that can serve the purpose and is worth reading, well organized and is pedagogical.
Cytowania: 50Influential: 1Open AccessDOI ↗PubMed ↗PDF ↗
Y. Piao, H. Peltoketo, Annukka Jouppila et al. (1997)
AI Summary
The present data indicate that RAs may stimulate estradiol biosynthesis by regulating 17HSD type 1 expression in certain breast cancer and choriocarcinoma cells and the results suggest that interaction of multiple regulatory pathways is involved in maintaining high 17 HSD type 2 expression in the placenta.
Cytowania: 32Influential: 3$ Paywall
(1979) · National Toxicology Program technical report series
AI Summary
The findings of an increased incidence of a combination of adenomas and carcinomas of the lung provided suggestive evidence for the carcinogenicity of styrene in male B6C3F1 mice, but it is concluded that, under the conditions of this bioassay, no convincing evidence for this compound was obtained.
Cytowania: 22Influential: 2$ PaywallPubMed ↗
Patricia L. Vesely (2018) · Interpretation: A Journal of Bible and Theology
Cytowania: 1$ PaywallDOI ↗

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Sinonimi
Dimethyl acetylenedicarboxylate · 762-42-5 · 2-Butynedioic acid, dimethyl ester · Dimethyl 2-butynedioate · Bis(methoxycarbonyl)acetylene · Di(carbomethoxy)acetylene · 1,2-Bis(methoxycarbonyl)acetylene · Acetylenedicarboxylic acid dimethyl ester · Dimethyl ethynedicarboxylate · Acetylenedicarboxylic acid, dimethyl ester · 1,2-Bis(methoxycarbonyl)ethyne · 7HZA2PL15F · 2-Butynedioic acid, 1,4-dimethyl ester · NSC-14912 · NSC-101119
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