2-Chloro-1-(1-methylpropyl)-3,5-dinitrobenzene

CAS Registry Number®

19921-90-5
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CAS Name

2-Chloro-1-(1-methylpropyl)-3,5-dinitrobenzene

Molecular Formula

C10H11ClN2O4

Molecular Mass

258.66

Cite this Page

2-Chloro-1-(1-methylpropyl)-3,5-dinitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19921-90-5 (retrieved 2024-09-15) (CAS RN: 19921-90-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    49-50 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H11ClN2O4/c1-3-6(2)8-4-7(12(14)15)5-9(10(8)11)13(16)17/h4-6H,3H2,1-2H3

InChIKey

InChIKey=MNAALDAFPOJOIU-UHFFFAOYSA-N

SMILES

C(CC)(C)C1=C(Cl)C(N(=O)=O)=CC(N(=O)=O)=C1

Canonical SMILES

O=N(=O)C=1C=C(C(Cl)=C(C1)C(C)CC)N(=O)=O

Other Names for this Substance

  • Benzene, 2-chloro-1-(1-methylpropyl)-3,5-dinitro-
  • Benzene, 1-sec-butyl-2-chloro-3,5-dinitro-
  • 2-Chloro-1-(1-methylpropyl)-3,5-dinitrobenzene
  • (+-)-1-sec-Butyl-2-chloro-3,5-dinitro-benzene