Basic information
- Standard SMILES
COc1ccc(C(=O)O)c(CC(=O)O)c1- InChIKey
BOLRXRKAHDAYHL-UHFFFAOYSA-N- Molecular formula
- C10H10O5
- Average molar mass
- 210.18 g/mol
- Monoisotopic mass
- 210.05282342
Names & identifiers
- Preferred name
- 2-(Carboxymethyl)-4-methoxybenzoic acid
- IUPAC
- 2-(carboxymethyl)-4-methoxybenzoic acid
Names & synonyms
2-(Carboxymethyl)-4-methoxybenzoic acid68294-03-1MFCD193704492-(carboxymethyl)-4-methoxy-benzoic AcidSCHEMBL744543BOLRXRKAHDAYHL-UHFFFAOYSA-N2-carboxymethyl-4-methoxybenzoic acid2-(Carboxymethyl)-4-methoxybenzoicacid2-carboxymethyl-4-methoxy-benzoic acidBS-29398DB-087721G62923
Database identifiers
- PubChem CID
- 11816626
- Nikkaji
- J1.684.214A
Properties
Computed structural properties
- XLogP
- 0.9
- 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
- 250
Related reactions
8 records
Compound notes
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