Basic information
- CAS
21003-78-1- Standard SMILES
O=C(O)c1ccccc1Nc1cccc(O)c1- InChIKey
YQULREKUYCCSJA-UHFFFAOYSA-N- Molecular formula
- C13H11NO3
- Average molar mass
- 229.23 g/mol
- Monoisotopic mass
- 229.07389321
Names & identifiers
- Preferred name
- Anthranilic acid, N-(m-hydroxyphenyl)-
- IUPAC
- 2-(3-hydroxyanilino)benzoic acid
Names & synonyms
N-(m-Hydroxyphenyl)anthranilic acid21003-78-1Anthranilic acid, N-(m-hydroxyphenyl)-BRN 2808892DTXSID90175211RefChem:319835DTXCID40977022-(3-hydroxyanilino)benzoic acidCHEMBL23592SCHEMBL9719838DB-141275
Database identifiers
- CAS
21003-78-1- PubChem CID
- 88751
- DTXSID
DTXSID90175211- ChEMBL
CHEMBL23592- Nikkaji
- J548.721H
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 269
Experimental & physicochemical properties
LogP3.43
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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