CAS 394-31-0 5-Hydroxyanthranilic acid (HCID 164592)

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Basic information

CAS: 394-31-0
Standard SMILES: Nc1ccc(O)cc1C(=O)O
InChIKey: HYNQTSZBTIOFKH-UHFFFAOYSA-N
Molecular formula: C7H7NO3
Average molar mass: 153.14 g/mol
Monoisotopic mass: 153.04259308

Overview

2-Amino-5-hydroxybenzoic acid is a hydroxybenzoic acid.

Names & identifiers

Preferred name: 5-Hydroxyanthranilic acid
IUPAC: 2-amino-5-hydroxybenzoic acid
English name: 394-31-0
Molecular weight: 0

Names & synonyms

2-Amino-5-hydroxybenzoic acid5-Hydroxyanthranilic acid394-31-0DiabetonUF9WW3I410DTXSID70192587RefChem:536231DTXCID10115078628-812-6Benzoic acid, 2-amino-5-hydroxy-MFCD000078702-amino-5-hydroxy-benzoic acid

Show more names

UNII-UF9WW3I410SCHEMBL258366CHEBI:181437AKOS0001197735-HYDROXYANTHRANILIC ACID [WHO-DD]H063110.14272/HYNQTSZBTIOFKH-UHFFFAOYSA-N.1Q27291057

Database identifiers

CAS: 394-31-0
PubChem CID: 164592
DTXSID: DTXSID70192587
ChEBI: CHEBI:181437
UNII: UF9WW3I410
EC Number: 628-812-6
Nikkaji: J71.710J

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 83.6 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 160

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (86%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.