Basic information
- Standard SMILES
N#C/C=C/c1cccc(OC(F)(F)F)c1- InChIKey
USJNORRWSWFMEP-DUXPYHPUSA-N- Molecular formula
- C10H6F3NO
- Average molar mass
- 213.16 g/mol
Names & identifiers
- Preferred name
- (E)-3-(3-(trifluoromethoxy)phenyl)acrylonitrile
- IUPAC
- (E)-3-[3-(trifluoromethoxy)phenyl]prop-2-enenitrile
Names & synonyms
(E)-3-(3-(trifluoromethoxy)phenyl)acrylonitrileSCHEMBL14814206
Database identifiers
- PubChem CID
- 86680352
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 276
Related reactions
1 records
Compound notes
Loading…