3-Aminobenzoic acid
Properties
- Molecular formula
- C7H7NO2
- Molar mass
- 137.14 g/mol
- Exact mass
- 137.0477 Da
- Melting point
- 173 °C
- logP
- 0.97Crippen estimate
- Polar surface area
- 63.3 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed78.8% of notifiers
- H315 Causes skin irritation98.1% of notifiers
- H319 Causes serious eye irritation98.1% of notifiers
- H335 May cause respiratory irritation96.2% of notifiers
Aggregated from 52 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
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, P501
Identifiers
CAS number
99-05-8SMILES
Nc1cccc(C(=O)O)c1InChIKey
XFDUHJPVQKIXHO-UHFFFAOYSA-NInChI
InChI=1S/C7H7NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H,9,10)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Benzoic acid, 3-amino-
- Benzoic acid, m-amino-
- m-Aminobenzoic acid
- m-Carboxyaniline
- 3-Carboxyaniline
- Aniline-3-carboxylic acid
- m-Carboxyphenylamine
- NSC 15012
- m-Anthranilic acid
- 3-Aminobenzenecarboxylic acid
Work with 3-Aminobenzoic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Isophthalic acid121-91-569 % similar
3,5-Diaminobenzoic acid535-87-564 % similar
3,5-Dicarboxyaniline99-31-064 % similar
6-Amino-2-naphthoic acid116668-47-463 % similar
3,3'-Diaminobenzophenone611-79-062 % similar
3-Fluorobenzoic acid455-38-958 % similar
3-Chlorobenzoic acid535-80-858 % similar
3-Bromobenzoic acid585-76-258 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.