CAS Registry Number®
89-69-0
CAS Name
2,4,5-Trichloronitrobenzene
Molecular Formula
C6H2Cl3NO2
Molecular Mass
226.44
Compound Properties
-
Boiling Point (1)
288 °C
-
Melting Point (1)
57.5 °C
-
Density (2)
1.790 g/cm³ @ Temp: 20 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Ginzburg, B. M.; Russian Journal of Applied Chemistry, (2009), 82(7), 1178-1187, CAplus
Other Names and Identifiers
InChI
InChI=1S/C6H2Cl3NO2/c7-3-1-5(9)6(10(11)12)2-4(3)8/h1-2H
InChIKey
InChIKey=IBRBMZRLVYKVRF-UHFFFAOYSA-N
SMILES
N(=O)(=O)C1=C(Cl)C=C(Cl)C(Cl)=C1
Canonical SMILES
O=N(=O)C1=CC(Cl)=C(Cl)C=C1Cl
Other Names for this Substance
- Benzene, 1,2,4-trichloro-5-nitro-
- 1,2,4-Trichloro-5-nitrobenzene
- 2,4,5-Trichloro-1-nitrobenzene
- 2,4,5-Trichloronitrobenzene
- 3,4,6-Trichloronitrobenzene
