Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC=C1c2ccccc2COc2ccc(C#N)cc21- InChIKey
BBMDMLTWXADRCO-UHFFFAOYSA-N- Molecular formula
- C17H13NO
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.09971404
Names & identifiers
- Preferred name
- 2-Cyano-6,11-dihydro-11-ethylidenedibenz[b,e]oxepin
- IUPAC
- 11-ethylidene-6H-benzo[c][1]benzoxepine-2-carbonitrile
Names & synonyms
SCHEMBL10925613BBMDMLTWXADRCO-UHFFFAOYSA-N2-Cyano-6,11-dihydro-11-ethylidenedibenz[b,e]oxepin
Database identifiers
- PubChem CID
- 53673425
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 405
Related reactions
2 records
Compound notes
Loading…