Tert-butyl 4-chloro-2-hydroxybenzoate
Basic information
- CAS
1092460-52-0- Standard SMILES
CC(C)(C)OC(=O)c1ccc(Cl)cc1O- InChIKey
MAHLRJXOEDHGSJ-UHFFFAOYSA-N- Molecular formula
- C11H13ClO3
- Average molar mass
- 228.67 g/mol
- Monoisotopic mass
- 228.055322
Names & identifiers
- Preferred name
- Tert-butyl 4-chloro-2-hydroxybenzoate
- IUPAC
- tert-butyl 4-chloro-2-hydroxybenzoate
- English name
- TERT-BUTYL 4-CHLORO-2-HYDROXYBENZOATE
- Molecular formula
- C11H13ClO3
- Molecular weight
- 228.67
Names & synonyms
TERT-BUTYL 4-CHLORO-2-HYDROXYBENZOATE1092460-52-0MFCD11501909DTXSID401256555AR2828AKOS013211233tert-butyl 4-chloro-2-hydroxy-benzoateAS-45454CS-0171702TERT-BUTYL4-CHLORO-2-HYDROXYBENZOATE1,1-Dimethylethyl 4-chloro-2-hydroxybenzoateF306362
Show more names
Benzoic acid, 4-chloro-2-hydroxy-, 1,1-dimethylethyl ester
Database identifiers
- CAS
1092460-52-0- PubChem CID
- 45926145
- DTXSID
DTXSID401256555
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
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Compound notes
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