Basic information
- CAS
49649-27-6- Standard SMILES
CN=Cc1cc(Cl)ccc1O- InChIKey
SJMVDYATGBLKAT-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO
- Average molar mass
- 169.61 g/mol
- Monoisotopic mass
- 169.0294416
Names & identifiers
- Preferred name
- 4-Chloro-alpha-(methylimino)-o-cresol
- IUPAC
- 4-chloro-2-(methyliminomethyl)phenol
Names & synonyms
4-Chloro-alpha-(methylimino)-o-cresol49649-27-6BRN 20824515-Chlor-2-hydroxybenzylidenmethylamin [German]o-CRESOL, 4-CHLORO-alpha-(METHYLIMINO)-5-Chlor-2-hydroxybenzylidenmethylamin
Database identifiers
- CAS
49649-27-6- PubChem CID
- 39505
- Nikkaji
- J67.706J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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