Basic information
- CAS
38586-17-3- Standard SMILES
CC=C(C#N)c1ccccc1- InChIKey
ZYBPSQSGQRMLDY-UHFFFAOYSA-N- Molecular formula
- C10H9N
- Average molar mass
- 143.18 g/mol
- Monoisotopic mass
- 143.07349929
Names & identifiers
- Preferred name
- 2-Phenyl-2-butenonitrile
- IUPAC
- 2-phenylbut-2-enenitrile
Names & synonyms
2-phenylbut-2-enenitrilephenylbutenenitrile2-phenyl-2-butenonitrileSCHEMBL1342675ZYBPSQSGQRMLDY-UHFFFAOYSA-N
Database identifiers
- CAS
38586-17-3- PubChem CID
- 296757
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 188
Related reactions
3 records
Compound notes
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