4-Chloro-1,2-dinitrobenzene
Properties
- Molecular formula
- C6H3ClN2O4
- Molar mass
- 202.55 g/mol
- Exact mass
- 201.9781 Da
- Density
- 1.69 g/mL
- Melting point
- 40 °C
- Flash point
- 110 °C
- logP
- 2.16Crippen estimate
- Polar surface area
- 86.3 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 2
Hazards
Danger
- H301 Toxic if swallowed100% of notifiers
- H311 Toxic in contact with skin97.8% of notifiers
- H331 Toxic if inhaled91.1% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure97.8% of notifiers
- H400 Very toxic to aquatic life100% of notifiers
- H410 Very toxic to aquatic life with long lasting effects97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
610-40-2SMILES
O=[N+]([O-])c1ccc(Cl)cc1[N+](=O)[O-]InChIKey
QVQSOXMXXFZAKU-UHFFFAOYSA-NInChI
InChI=1S/C6H3ClN2O4/c7-4-1-2-5(8(10)11)6(3-4)9(12)13/h1-3HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Benzene, 4-chloro-1,2-dinitro-
- 1-Chloro-3,4-dinitrobenzene
- 3,4-Dinitrochlorobenzene
- 1,2-Dinitro-4-chlorobenzene
- NSC 119343
Work with 4-Chloro-1,2-dinitrobenzene
Similar compounds
2,4-Dichloronitrobenzene611-06-372 % similar
1,4-Dichloro-2-nitrobenzene89-61-272 % similar
5-Chloro-2-nitroaniline1635-61-668 % similar
4-Chloro-1-fluoro-2-nitrobenzene345-18-668 % similar
1-Bromo-4-chloro-2-nitrobenzene41513-04-668 % similar
4-Chloro-2-methyl-1-nitrobenzene5367-28-268 % similar
4-Chloro-2-fluoro-1-nitrobenzene700-37-868 % similar
4-Chloro-1-methyl-2-nitrobenzene89-59-868 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.