Acetonitrile oxide
acetonitrile oxide
Also Known As: acetonitrile oxide|N-oxidoethanimine|CH3CNO|ethylidyneazane oxide|Ethanenitrile oxide|ACETONITRILE N-OXIDE|1-Aza-1-propyne1-oxide|CH3-C#NO|(ethylidyneazaniumyl)oxidanide
CAS: 7063-95-8
| Molecular Formula | C2H3NO |
|---|---|
| Molecular Weight | 57.021465 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 57.021465 |
| Monoisotopic Mass | 57.021465 |
| Heavy Atoms | 4 |
| Complexity | 54.0 |
Chemical Identifiers
| CAS Number | 7063-95-8 |
|---|---|
| SMILES | CC#[N+][O-] |
| InChIKey | PFCUZDIEKKTHCH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (1 patents)
Heterocyclic Building Blocks (31 patents)
Pharmaceutical Intermediates (19 patents)
Product Overview
Acetonitrile oxide (CAS 7063-95-8), with molecular formula C2H3NO and molecular weight 57.021465 g/mol. IUPAC: acetonitrile oxide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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