Basic information
- Standard SMILES
COC1=CC(=C(C#N)c2ccccc2)C=CC1=NO- InChIKey
YBKTXKZDUUDTKN-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2
- Average molar mass
- 252.27 g/mol
Names & identifiers
- Preferred name
- (4-Hydroxyimino-3-methoxy-cyclohexa-2,5-dienylidene)-phenylacetonitrile
- IUPAC
- 2-(4-hydroxyimino-3-methoxycyclohexa-2,5-dien-1-ylidene)-2-phenylacetonitrile
Names & synonyms
SCHEMBL7704257YBKTXKZDUUDTKN-UHFFFAOYSA-N(4-Hydroxyimino-3-methoxy-cyclohexa-2,5-dienylidene)-phenylacetonitrile
Database identifiers
- PubChem CID
- 346837
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 512
Related reactions
1 records
Compound notes
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