2-(Carboxymethyl)-4-chlorobenzoic acid
Basic information
- CAS
63177-08-2- Standard SMILES
O=C(O)Cc1cc(Cl)ccc1C(=O)O- InChIKey
WVTJEXSVQSHCPZ-UHFFFAOYSA-N- Molecular formula
- C9H7ClO4
- Average molar mass
- 214.6 g/mol
- Monoisotopic mass
- 214.0032864
Names & identifiers
- Preferred name
- 2-(Carboxymethyl)-4-chlorobenzoic acid
- IUPAC
- 2-(carboxymethyl)-4-chlorobenzoic acid
Names & synonyms
2-(carboxymethyl)-4-chlorobenzoic acid63177-08-2MFCD237022202-carboxymethyl-4-chlorobenzic acidNSC3382305-chlorohomophthalic acidSCHEMBL1022607DTXSID00318970WVTJEXSVQSHCPZ-UHFFFAOYSA-N2-carboxymethyl-4-chlorobenzoic acidAT38488NSC-338230
Show more names
2-(carboxymethyl)-4-chloro-benzoic acidBS-34927SY473393F989455
Database identifiers
- CAS
63177-08-2- PubChem CID
- 334035
- DTXSID
DTXSID00318970
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 241
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
6 records
Compound notes
Loading…