Basic information
- CAS
870-64-4- Standard SMILES
C/C(N)=C/C#N- InChIKey
DELJOESCKJGFML-RQOWECAXSA-N- Molecular formula
- C4H6N2
- Average molar mass
- 82.1 g/mol
- Monoisotopic mass
- 82.05309819
Names & identifiers
- Preferred name
- (2Z)-3-Amino-2-butenenitrile
- IUPAC
- (Z)-3-aminobut-2-enenitrile
Names & synonyms
870-64-4(2Z)-3-Amino-2-butenenitrileRefChem:207237(Z)-3-aminobut-2-enenitrile(2Z)-3-aminobut-2-enenitrilebeta-Aminocrotononitrile2-Butenenitrile, 3-amino-, (2Z)-3-amino-crotononitrilebeta-Amino-crotononitrileSCHEMBL294653CTK3C5749DELJOESCKJGFML-RQOWECAXSA-N
Show more names
DTXSID501308703AKOS015894485CS-0005803EN300-17350F8886-8252
Database identifiers
- CAS
870-64-4- PubChem CID
- 5325263
- DTXSID
DTXSID501308703- Nikkaji
- J203.342I、J79.989K
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
- 6
- Formal charge
- 0
- Complexity
- 104
Related reactions
66 records
Compound notes
Loading…