Basic information
- Standard SMILES
COc1ccc(C(C)O)c(Cl)c1- InChIKey
NEYMRJQYYHDEKA-UHFFFAOYSA-N- Molecular formula
- C9H11ClO2
- Average molar mass
- 186.63 g/mol
- Monoisotopic mass
- 186.0447573
Names & identifiers
- Preferred name
- 1-(2-Chloro-4-methoxy-phenyl)-ethanol
- IUPAC
- 1-(2-chloro-4-methoxyphenyl)ethanol
Names & synonyms
89691-59-81-(2-chloro-4-methoxyphenyl)ethanol1-(2-Chloro-4-methoxy-phenyl)-ethanolSCHEMBL474013NEYMRJQYYHDEKA-UHFFFAOYSA-NMFCD12788154
Database identifiers
- PubChem CID
- 21755593
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 140
Related reactions
6 records
Compound notes
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