Basic information
- CAS
61888-74-2- Standard SMILES
COc1cc(C(=O)O)cc(-c2ccc(Cl)cc2)c1- InChIKey
CQECLZXFANKLPX-UHFFFAOYSA-N- Molecular formula
- C14H11ClO3
- Average molar mass
- 262.69 g/mol
- Monoisotopic mass
- 262.0396719
Names & identifiers
- Preferred name
- 3-Biphenylcarboxylic acid, 4'-chloro-5-methoxy-
- IUPAC
- 3-(4-chlorophenyl)-5-methoxybenzoic acid
- English name
- 4'-Chloro-5-methoxy-3-biphenylcarboxylic acid
- Molecular formula
- C14H11ClO3
- Molecular weight
- 262.69
Names & synonyms
61888-74-2BRN 21175413-BIPHENYLCARBOXYLIC ACID, 4'-CHLORO-5-METHOXY-4'-Chloro-5-methoxy-3-biphenylcarboxylic acidDTXSID90210898RefChem:277127DTXCID201333893-(4-chlorophenyl)-5-methoxybenzoic acidMFCD01740376[1,1'-Biphenyl]-3-carboxylicacid, 4'-chloro-5-methoxy-CHEMBL32445503-(4-chlorophenyl)-5-methoxy-benzoic acid
Show more names
CL-3162464'-Chloro-5-methoxybiphenyl-3-carboxylic acid4'-Chloro-5-methoxy-1,1'-biphenyl-3-carboxylic acid[1,1'-Biphenyl]-3-carboxylic acid, 4'-chloro-5-methoxy-
DB-3057503-(4-Chlorophenyl)-5-methoxybenzoic acid, 95%4'-Chloro-5-methoxy[1,1'-biphenyl]-3-carboxylic acid
Database identifiers
- CAS
61888-74-2- PubChem CID
- 43848
- DTXSID
DTXSID90210898- ChEMBL
CHEMBL3244550
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 287
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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