Basic information
- Standard SMILES
CCOC(=O)C(Cl)C(O)Cc1ccccc1- InChIKey
UCFCLRSWVRCMHX-UHFFFAOYSA-N- Molecular formula
- C12H15ClO3
- Average molar mass
- 242.7 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-chloro-3-hydroxy-4-phenylbutanoate
- IUPAC
- ethyl 2-chloro-3-hydroxy-4-phenylbutanoate
Names & synonyms
SCHEMBL3682287
Database identifiers
- PubChem CID
- 73023237
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 214
Related reactions
1 records
Compound notes
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