2,3-Dichloronitrobenzene
Properties
- Molecular formula
- C6H3Cl2NO2
- Molar mass
- 192.00 g/mol
- Exact mass
- 190.9541 Da
- Density
- 1.721 g/mL (at 14 °C)
- Melting point
- 61.5 °C
- Boiling point
- 257.5 °C
- Flash point
- 123 °C
- Water solubility
- 62.4 mg/L (20 °C)
- logP
- 2.90Crippen estimate
- Polar surface area
- 43.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H301 Toxic if swallowed81.6% of notifiers
- H302 Harmful if swallowed18.4% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure12.2% of notifiers
- H411 Toxic to aquatic life with long lasting effects22.4% of notifiers
Aggregated from 49 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P270, P273, P301+P316, P301+P317, P319, P321, P330, P391, P405, P501
Identifiers
CAS number
3209-22-1SMILES
O=[N+]([O-])c1cccc(Cl)c1ClInChIKey
CMVQZRLQEOAYSW-UHFFFAOYSA-NInChI
InChI=1S/C6H3Cl2NO2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Benzene, 1,2-dichloro-3-nitro-
- 1,2-Dichloro-3-nitrobenzene
- 2,3-Dichloro-1-nitrobenzene
- NSC 60641
Work with 2,3-Dichloronitrobenzene
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-Chloro-1,3-dinitrobenzene606-21-377 % similar
2,3,4-Trichloronitrobenzene17700-09-372 % similar
2-Nitrochlorobenzene88-73-371 % similar
1-Chloro-2-fluoro-3-nitrobenzene2106-49-265 % similar
1-Bromo-2-chloro-3-nitrobenzene3970-37-465 % similar
2-Bromo-1-chloro-3-nitrobenzene19128-48-463 % similar
2-Chloro-1-fluoro-3-nitrobenzene21397-07-963 % similar
2-Chloro-1-methyl-3-nitrobenzene3970-40-963 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds
Same formula
3,5-Dichloroisonicotinic acid13958-93-5
Clopyralid1702-17-6
2,3-Dichloropyridine-4-carboxylic acid184416-84-0
2,4-Dichloronicotinic acid262423-77-8
2,6-Dichloronicotinic acid38496-18-3
5,6-Dichloronicotinic acid41667-95-2
2,6-Dichloroisonicotinic acid5398-44-7
2,5-Dichloropyridine-3-carboxylic acid59782-85-3