2,4-Dichloro-6-nitroaniline

C₆H₄Cl₂N₂O₂CAS 2683-43-4207.01 g/mol

Open in Covalent MOL file

Aryl halide Nitro Primary amine

Properties

Molecular formula: C₆H₄Cl₂N₂O₂
Molar mass: 207.01 g/mol
Exact mass: 205.9650 Da
Melting point: 102 °C
logP: 2.48Crippen estimate
Polar surface area: 69.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Danger

H300 Fatal if swallowed88.9% of notifiers
H310 Fatal in contact with skin88.9% of notifiers
H330 Fatal if inhaled88.9% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure91.1% of notifiers
H411 Toxic to aquatic life with long lasting effects88.9% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P262, P264, P270, P271, P273, P280, P284, P301+P316, P302+P352, P304+P340, P316, P319, P320, P321, P330, P361+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

2683-43-4

SMILES

Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-]

InChIKey

IZEZAMILKKYOPW-UHFFFAOYSA-N

InChI

InChI=1S/C6H4Cl2N2O2/c7-3-1-4(8)6(9)5(2-3)10(11)12/h1-2H,9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

Benzenamine, 2,4-dichloro-6-nitro-
Aniline, 2,4-dichloro-6-nitro-
2,4-Dichloro-6-nitrobenzenamine
4,6-Dichloro-2-nitroaniline
2-Nitro-4,6-dichloroaniline
NSC 28582
1-Nitro-2-amine-3,5-dichlorobenzene
2,4-Dichloro-6-nitro-phenylamine

Work with 2,4-Dichloro-6-nitroaniline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Chloro-2,4-dinitroaniline3531-19-971 % similar 4-Chloro-2-methyl-6-nitroaniline62790-50-567 % similar 2-Bromo-4-chloro-6-nitrobenzenamine827-25-867 % similar 2-Chloro-6-nitrobenzenamine769-11-965 % similar 4-Amino-3-chloro-5-nitrobenzotrifluoride57729-79-062 % similar 2,4-Dichloro-6-nitrophenol609-89-261 % similar 2,6-Dichloro-4-nitroaniline99-30-959 % similar 2,4,6-Trichloronitrobenzene18708-70-858 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Aminopyralid150114-71-9 Methyl 3,6-dichloropyridazine-4-carboxylate286946-24-5 Methyl2,4-dichloropyrimidine-5-carboxylate3177-20-6 4,6-Dichloropyridazine-3-carboxylic acid methyl ester372118-01-9 2,6-Dichloro-3-methyl-5-nitropyridine58596-88-6 2,6-Dichloro-4-methyl-3-nitropyridine60010-03-9 2,4-Dichloro-6-methyl-3-nitropyridine63897-12-1 2,5-Dichloro-4-nitrobenzenamine6627-34-5

Elsewhere

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