
Acetonitrile
Acetonitrile is a nitrile that is hydrogen cyanide in which the hydrogen has been replaced by a methyl group. It has a role as a polar aprotic solvent and an EC 3.5.1.4 (amidase) inhibitor. It is a volatile organic compound and an aliphatic nitrile. — ChEBI
- IUPAC name
- acetonitrile
- Molecular formula
- C2H3N
- Molecular weight
- 41.05 g/mol
- Exact mass
- 41.026549100 Da
- XLogP3
- 0.0
- Topological polar surface area
- 23.8 Ų
- Hydrogen-bond donors
- 0
- Hydrogen-bond acceptors
- 1
- Covalent units
- 1
- Defined stereocentres
- 0
Also known as
16 more reported names
External database identifiers
- ChEBI:CHEBI:38472
- ChEMBL:CHEMBL45211
- EPA DTXSID:DTXSID7020009
- PubMed:26275123
- PubMed:23125600
- PubMed:23124566
- PubMed:23122405
- PubMed:23122404
- PubMed:23122401
- PubMed:23122396
- PubMed:23122160
- PubMed:23122109
- PubMed:23122087
- PubMed:23117461
- PubMed:23117432
Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.