Basic information
- Standard SMILES
CC(C)OC(=O)c1ccc(Cl)c(O)c1- InChIKey
ICUHOPCLPYAFOV-UHFFFAOYSA-N- Molecular formula
- C10H11ClO3
- Average molar mass
- 214.64 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-3-hydroxy-benzoic acid isopropyl ester
- IUPAC
- propan-2-yl 4-chloro-3-hydroxybenzoate
Names & synonyms
SCHEMBL5368178ICUHOPCLPYAFOV-UHFFFAOYSA-N4-chloro-3-hydroxy-benzoic acid isopropyl ester
Database identifiers
- PubChem CID
- 69418989
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 206
Related reactions
1 records
Compound notes
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