1,2-Benzenediol, 3-[(phenylimino)methyl]-
Basic information
- CAS
141281-43-8- Standard SMILES
Oc1cccc(C=Nc2ccccc2)c1O- InChIKey
IKCNVDHSEBASIB-UHFFFAOYSA-N- Molecular formula
- C13H11NO2
- Average molar mass
- 213.23 g/mol
- Monoisotopic mass
- 213.07897859
Names & identifiers
- Preferred name
- 1,2-Benzenediol, 3-[(phenylimino)methyl]-
- IUPAC
- 3-(phenyliminomethyl)benzene-1,2-diol
- English name
- 1,2-Benzenediol, 3-[(phenylimino)methyl]-
- Molecular formula
- C13H11NO2
- Molecular weight
- 213.23
Names & synonyms
1,2-Benzenediol, 3-[(phenylimino)methyl]-141281-43-83-(Phenyliminomethyl)benzene-1,2-diol168915-06-8MFCD005888631,2-Benzenediol, 3-[(phenylimino)methyl]-, (E)- (9CI)168915-11-53-[(PHENYLIMINO)METHYL]BENZENE-1,2-DIOL3-Phenyliminomethyl-benzene-1,2-diol3-((Phenylimino)methyl)benzene-1,2-diol3-[(phenylimino)methyl]-1,2-benzenediol(6Z)-6-(anilinomethylidene)-2-hydroxycyclohexa-2,4-dien-1-one
Show more names
CBMicro_0161142,4-Cyclohexadien-1-one, 2-hydroxy-6-[(phenylamino)methylene]-, (Z)- (9CI)3-[(1E)-(phenylimino)methyl]benzene-1,2-diolGNF-Pf-2208CHEMBL532723SCHEMBL11408234SCHEMBL114082366-(anilinomethylidene)-2-hydroxycyclohexa-2,4-dien-1-one
Database identifiers
- CAS
141281-43-8- PubChem CID
- 693334
- DTXSID
DTXSID50425183- ChEMBL
CHEMBL532723- Nikkaji
- J676.562I
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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