2-(Carboxymethoxy)-5-chlorobenzoic acid
Basic information
- CAS
334758-22-4- Standard SMILES
O=C(O)COc1ccc(Cl)cc1C(=O)O- InChIKey
WXOXOMZXUQKTBM-UHFFFAOYSA-N- Molecular formula
- C9H7ClO5
- Average molar mass
- 230.6 g/mol
- Monoisotopic mass
- 229.998201
Names & identifiers
- Preferred name
- 2-(Carboxymethoxy)-5-chlorobenzoic acid
- IUPAC
- 2-(carboxymethoxy)-5-chlorobenzoic acid
Names & synonyms
2-(carboxymethoxy)-5-chlorobenzoic acid334758-22-4MCPA-carboxylic acidNSC525058Benzoic acid, 2-(carboxymethoxy)-5-chloro-SCHEMBL4143335DTXSID603261722-(carboxymethoxy)-5-chlorobenzoicacidNSC-525058EN300-1627560
Database identifiers
- CAS
334758-22-4- PubChem CID
- 352118
- DTXSID
DTXSID60326172
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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