1,3-Dichloro-2-nitrobenzene

C6H3Cl2NO2CAS 601-88-7192.00 g/mol

ON+O−ClCl
Aryl halideNitro

Properties

Molecular formula
C6H3Cl2NO2
Molar mass
192.00 g/mol
Exact mass
190.9541 Da
Density
1.6 g/mL
Melting point
72.5 °C
Boiling point
130 °C (at 8.3 Torr)
logP
2.90Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Danger
Acute Toxic (GHS06)Irritant (GHS07)Health Hazard (GHS08)Environmental Hazard (GHS09)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P262, P264, P270, P272, P273, P280, P301+P317, P302+P352, P316, P318, P321, P330, P333+P317, P361+P364, P362+P364, P391, P405, P501

Identifiers

CAS number
601-88-7
SMILES
O=[N+]([O-])c1c(Cl)cccc1Cl
InChIKey
VITSNECNFNNVQB-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl2NO2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H

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Names and synonyms

3 names
  • Benzene, 1,3-dichloro-2-nitro-
  • 2,6-Dichloronitrobenzene
  • 2,6-Dichloro-1-nitrobenzene

Reactions

Work with 1,3-Dichloro-2-nitrobenzene

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Elsewhere