2-Methyl-5-nitrobenzonitrile

CAS Registry Number®

939-83-3

CAS Name

2-Methyl-5-nitrobenzonitrile

Molecular Formula

C8H6N2O2

Molecular Mass

162.15

Cite this Page

2-Methyl-5-nitrobenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=939-83-3 (retrieved 2024-11-22) (CAS RN: 939-83-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    113-115 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6N2O2/c1-6-2-3-8(10(11)12)4-7(6)5-9/h2-4H,1H3

InChIKey

InChIKey=XOSDYLFXPMFRGF-UHFFFAOYSA-N

SMILES

C(#N)C1=CC(N(=O)=O)=CC=C1C

Canonical SMILES

N#CC1=CC(=CC=C1C)N(=O)=O

Other Names for this Substance

  • Benzonitrile, 2-methyl-5-nitro-
  • o-Tolunitrile, 5-nitro-
  • 2-Methyl-5-nitrobenzonitrile
  • 2-Cyano-4-nitrotoluene
  • 5-Nitro-o-tolunitrile

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration