4-Iodo-3-methylbenzonitrile

CAS Registry Number®

42872-85-5

CAS Name

4-Iodo-3-methylbenzonitrile

Molecular Formula

C8H6IN

Molecular Mass

243.04

Cite this Page

4-Iodo-3-methylbenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42872-85-5 (retrieved 2024-11-22) (CAS RN: 42872-85-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    73-75 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=HLTCSOXVOUXEJH-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(I)C(=C1)C

Other Names for this Substance

  • Benzonitrile, 4-iodo-3-methyl-
  • 4-Iodo-3-methylbenzonitrile
  • 4-Iodo-m-tolunitrile

CAS INSIGHTSTM
Targeted protein degrader structure, illustration