Basic information
- CAS
25293-29-2- Standard SMILES
Nc1cccc(Nc2ccccc2C(=O)O)c1- InChIKey
UIPDOEPZZQRQKQ-UHFFFAOYSA-N- Molecular formula
- C13H12N2O2
- Average molar mass
- 228.25 g/mol
- Monoisotopic mass
- 228.08987763
Names & identifiers
- Preferred name
- Anthranilic acid, N-(m-aminophenyl)-
- IUPAC
- 2-(3-aminoanilino)benzoic acid
- English name
- 2-[(3-Aminophenyl)amino]benzoic acid
- Molecular formula
- C13H12N2O2
- Molecular weight
- 228.25
Names & synonyms
Anthranilic acid, N-(m-aminophenyl)-N-(m-Aminophenyl)anthranilic acidBRN 2733630N-(3'-Aminophenyl)anthranilic acid25293-29-2Benzoic acid, 2-((3-aminophenyl)amino)-DTXSID101799333-14-00-00947 (Beilstein Handbook Reference)RefChem:319834DTXCID70102424Benzoic acid, 2-((3-aminophenyl)amino)-(9CI)2-(3-aminoanilino)benzoic acid
Show more names
2-[(3-Aminophenyl)amino]benzoic acidBenzoic acid, 2-[(3-aminophenyl)amino]-
SCHEMBL31514810
Database identifiers
- CAS
25293-29-2- PubChem CID
- 212879
- DTXSID
DTXSID10179933- Nikkaji
- J88.337I
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 270
Physicochemical properties
- pka
- 4.72 · pKa 4.72(5–10%aq. acetone t=25±0.1 I=0.11) (Uncertain)
Chemistry & industry
Suppliers1 total
重庆福腾医药有限公司18696571988 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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