2-[(4-Hydroxyphenyl)amino]-5-methoxybenzoic acid
Basic information
- CAS
98156-58-2- Standard SMILES
COc1ccc(Nc2ccc(O)cc2)c(C(=O)O)c1- InChIKey
UXBDSYBHDVPAPI-UHFFFAOYSA-N- Molecular formula
- C14H13NO4
- Average molar mass
- 259.26 g/mol
- Monoisotopic mass
- 259.0844579
Names & identifiers
- Preferred name
- 2-[(4-Hydroxyphenyl)amino]-5-methoxybenzoic acid
- IUPAC
- 2-(4-hydroxyanilino)-5-methoxybenzoic acid
Names & synonyms
2-[(4-Hydroxyphenyl)amino]-5-methoxybenzoic acidSCHEMBL10834390DTXSID40123908898156-58-22-(4-hydroxyanilino)-5-methoxybenzoic acid
Database identifiers
- CAS
98156-58-2- PubChem CID
- 13424432
- DTXSID
DTXSID401239088
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…