1-Nitropropane

CAS 108-03-2  ·  C3H7NO2  ·  MW 89.09 g/mol

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3D model 1-Nitropropane, CAS 108-03-2, molecular formula C3H7NO2, molar mass 89.09 g/mol
About 1-Nitropropane

1-Nitropropane is a chemical compound registered under number CAS 108-03-2, with the molecular formula C3H7NO2, and a molar mass of 89.09 g/mol.

The molecule contains 13 atoms connected by 12 chemical bonds. The full systematic IUPAC name of this compound is 1-nitropropane. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 0.9 (positive value, a lipophilic compound), polar surface area PSA = 45.8 Ų, 0 donors and 2 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC3H7NO2
Masa molowa89.09 g/mol
IUPAC1-nitropropane
SMILESCCC[N+](=O)[O-]
InChIKeyJSZOAYXJRCEYSX-UHFFFAOYSA-N
logP (XLogP3)0.9
PSA45.8 Ų
HBD / HBA0 / 2
PubChem CIDCID 7903 ↗
GHS safety

Signal word: Warning

GHS02
GHS02
GHS07
GHS07

H226 — Łatwopalna ciecz i pary

H332 — Działa szkodliwie w następstwie wdychania

H312 — Działa szkodliwie w kontakcie ze skórą

H302 — Działa szkodliwie po połknięciu

Scientific literature

Related literature

9 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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📈 Publication timeline (9 articles)

1982: 1 articles19821987: 2 articles1988: 1 articles1989: 1 articles1990: 1 articles19901991: 1 articles1992: 1 articles1994: 1 articles1994

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

Synonyms
1-NITROPROPANE · 108-03-2 · Propane, 1-nitro- · NSC-6363 · 39W305OW99 · DTXCID50980 · CHEBI:76261 · RefChem:76597 · 203-544-9 · Nitropropane · 1-nitro-propane · MFCD00007407 · Propane, nitro- · Nitropropane, 1- · CAS-108-03-2
Data sources
Related molecules
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📜 License & provenanceMolGod_License_1
Model
1-Nitropropane · 108-03-2
License
CC BY 4.0 International (source rights undetermined — not yet granted)
Attribution
MolGod Scientific
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Source data
PubChem CID 7903 ↗
SHA-256 (STL)
070102ea83a16c941b6f8213342cd88c6e7ad649c701c9c509d289d6398e9a06
Wikimedia Commons
not published yet
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