1,2-Dichloro-4-nitrobenzene
Properties
- Molecular formula
- C6H3Cl2NO2
- Molar mass
- 192.00 g/mol
- Exact mass
- 190.9541 Da
- Density
- 1.4558 g/mL (at 75 °C)
- Melting point
- 43 °C
- Boiling point
- 255–256 °C
- logP
- 2.90Crippen estimate
- Polar surface area
- 43.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Identifiers
CAS number
99-54-7SMILES
O=[N+]([O-])c1ccc(Cl)c(Cl)c1InChIKey
NTBYINQTYWZXLH-UHFFFAOYSA-NInChI
InChI=1S/C6H3Cl2NO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- Benzene, 1,2-dichloro-4-nitro-
- 3,4-Dichloronitrobenzene
- 1-Nitro-3,4-dichlorobenzene
- NSC 6295
- NSC 99806
- DCNB
- 4-Nitro-1,2-dichlorobenzene
Work with 1,2-Dichloro-4-nitrobenzene
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
2,4-Dinitrochlorobenzene97-00-772 % similar
2-Chloro-4-nitrotoluene121-86-868 % similar
2-Chloro-4-nitroaniline121-87-968 % similar
1-Chloro-2-methyl-4-nitrobenzene13290-74-968 % similar
2-Bromo-1-chloro-4-nitrobenzene16588-26-468 % similar
1-Bromo-2-chloro-4-nitrobenzene29682-39-168 % similar
3-Chloro-4-fluoronitrobenzene350-30-168 % similar
1-Chloro-2-fluoro-4-nitrobenzene350-31-268 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds