3,4-Dinitroaniline
Properties
- Molecular formula
- C6H5N3O4
- Molar mass
- 183.12 g/mol
- Exact mass
- 183.0280 Da
- Melting point
- 153–154 °C
- logP
- 1.09Crippen estimate
- Polar surface area
- 112.3 Ų
- H-bond donors / acceptors
- 1 / 5
- Rotatable bonds
- 2
Hazards
Danger
- H301 Toxic if swallowed100% of notifiers
- H311 Toxic in contact with skin100% of notifiers
- H331 Toxic if inhaled100% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure97.4% of notifiers
Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P403+P233, P405, P501
Identifiers
CAS number
610-41-3SMILES
Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1InChIKey
IPZPZSUDOPUDPM-UHFFFAOYSA-NInChI
InChI=1S/C6H5N3O4/c7-4-1-2-5(8(10)11)6(3-4)9(12)13/h1-3H,7H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Benzenamine, 3,4-dinitro-
- Aniline, 3,4-dinitro-
- 3,4-Dinitrobenzenamine
Work with 3,4-Dinitroaniline
Similar compounds
4-Nitro-m-phenylenediamine5131-58-872 % similar
2-Nitro-4-phenylenediamine5307-14-272 % similar
4-Methyl-3-nitroaniline119-32-468 % similar
4-Amino-2-nitrophenol119-34-668 % similar
3-Fluoro-4-nitrobenzenamine2369-13-368 % similar
4-Fluoro-3-nitroaniline364-76-168 % similar
4-Bromo-3-nitrobenzenamine53324-38-268 % similar
3-Methyl-4-nitroaniline611-05-268 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.