5-Amino-2-nitrobenzoic acid
Properties
- Molecular formula
- C7H6N2O4
- Molar mass
- 182.14 g/mol
- Exact mass
- 182.0328 Da
- logP
- 0.88Crippen estimate
- Polar surface area
- 106.5 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 2
Hazards
Danger
- H272 May intensify fire; oxidizer33.3% of notifiers
- H315 Causes skin irritation75% of notifiers
- H319 Causes serious eye irritation75% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 12 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P220, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, P501
Identifiers
CAS number
13280-60-9SMILES
Nc1ccc([N+](=O)[O-])c(C(=O)O)c1InChIKey
KZZWQCKYLNIOBT-UHFFFAOYSA-NInChI
InChI=1S/C7H6N2O4/c8-4-1-2-6(9(12)13)5(3-4)7(10)11/h1-3H,8H2,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzoic acid, 5-amino-2-nitro-
- 2-Nitro-5-aminobenzoic acid
- 3-Carboxy-4-nitroaniline
- NSC 74455
Work with 5-Amino-2-nitrobenzoic acid
Similar compounds
4-Amino-2-nitrobenzoic acid610-36-678 % similar
2,5-Dinitrobenzoic acid610-28-668 % similar
5-Hydroxy-2-nitrobenzoic acid610-37-767 % similar
5-Chloro-2-nitrobenzoic acid2516-95-265 % similar
5-Methyl-2-nitrobenzoic acid3113-72-265 % similar
5-Fluoro-2-nitrobenzoic acid320-98-965 % similar
Ellman's reagent69-78-365 % similar
5-Bromo-2-nitro-benzoic acid6950-43-265 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.