2-Chloro-4-nitrotoluene

CAS Registry Number®

121-86-8

CAS Name

2-Chloro-4-nitrotoluene

Molecular Formula

C7H6ClNO2

Molecular Mass

171.58

Cite this Page

2-Chloro-4-nitrotoluene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=121-86-8 (retrieved 2024-11-22) (CAS RN: 121-86-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    260 °C @ Press: 760 Torr

  • Melting Point (1)

    68 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C7H6ClNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3

InChIKey

InChIKey=LLYXJBROWQDVMI-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzene, 2-chloro-1-methyl-4-nitro-
  • Toluene, 2-chloro-4-nitro-
  • 2-Chloro-1-methyl-4-nitrobenzene
  • 2-Chloro-4-nitrotoluene
  • 3-Chloro-4-methylnitrobenzene

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration