2-Aminoacrylonitrile
Basic information
- CAS
69245-10-9- Standard SMILES
C=C(N)C#N- InChIKey
ZFFWIOSEDOAZAY-UHFFFAOYSA-N- Molecular formula
- C3H4N2
- Average molar mass
- 68.08 g/mol
- Monoisotopic mass
- 68.03744814
Names & identifiers
- Preferred name
- 2-Aminoacrylonitrile
- IUPAC
- 2-aminoprop-2-enenitrile
Names & synonyms
2-Aminoacrylonitrile2-aminoprop-2-enenitrile2-Aminopropenenitrile2-Propenenitrile, 2-amino-aminoacrylonitrile69245-10-9SCHEMBL459630SCHEMBL27490278DTXSID10337475ZFFWIOSEDOAZAY-UHFFFAOYSA-NAKOS006337510
Database identifiers
- CAS
69245-10-9- PubChem CID
- 543014
- DTXSID
DTXSID10337475- Nikkaji
- J399.203I
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 84.3
Experimental & physicochemical properties
SpringerMaterials PropertiesCoriolis coupling
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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