5-Iodo-2-methylbenzonitrile

CAS Registry Number®

52107-68-3

CAS Name

5-Iodo-2-methylbenzonitrile

Molecular Formula

C8H6IN

Molecular Mass

243.04

Cite this Page

5-Iodo-2-methylbenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52107-68-3 (retrieved 2024-11-22) (CAS RN: 52107-68-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    72-73 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6IN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3

InChIKey

InChIKey=QPGQEWLZKVSLPK-UHFFFAOYSA-N

SMILES

C(#N)C1=C(C)C=CC(I)=C1

Canonical SMILES

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

Other Names for this Substance

  • Benzonitrile, 5-iodo-2-methyl-
  • o-Tolunitrile, 5-iodo-
  • 5-Iodo-2-methylbenzonitrile

CAS INSIGHTSTM
Targeted protein degrader structure, illustration