1,4-Dichloro-2-nitrobenzene
Properties
- Molecular formula
- C6H3Cl2NO2
- Molar mass
- 192.00 g/mol
- Exact mass
- 190.9541 Da
- Density
- 1.704 g/mL (at 16 °C)
- Melting point
- 56 °C
- Boiling point
- 267 °C
- logP
- 2.90Crippen estimate
- Polar surface area
- 43.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Identifiers
CAS number
89-61-2SMILES
O=[N+]([O-])c1cc(Cl)ccc1ClInChIKey
RZKKOBGFCAHLCZ-UHFFFAOYSA-NInChI
InChI=1S/C6H3Cl2NO2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
10 names
- Benzene, 1,4-dichloro-2-nitro-
- Benzene, 1,4-dichloro-3-nitro-
- 2,5-Dichloronitrobenzene
- Nitro-p-dichlorobenzene
- 2,5-Dichloro-1-nitrobenzene
- 1-Nitro-2,5-dichlorobenzene
- 1,4-Dichloro-3-nitrobenzene
- 2-Nitro-1,4-dichlorobenzene
- NSC 406125
- NSC 6294
Work with 1,4-Dichloro-2-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
4-Chloro-1,2-dinitrobenzene610-40-272 % similar
2,4-Dinitrochlorobenzene97-00-768 % similar
1-Chloro-4-fluoro-2-nitrobenzene345-17-566 % similar
4-Bromo-1-chloro-2-nitrobenzene16588-24-264 % similar
4-Chloro-1-fluoro-2-nitrobenzene345-18-664 % similar
1-Bromo-4-chloro-2-nitrobenzene41513-04-664 % similar
4-Chloro-3-nitrophenol610-78-664 % similar
4-Chloro-3-nitroaniline635-22-364 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds