4-Cyanophenyl isothiocyanate

CAS Registry Number®

2719-32-6

CAS Name

4-Cyanophenyl isothiocyanate

Molecular Formula

C8H4N2S

Molecular Mass

160.20

Cite this Page

4-Cyanophenyl isothiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2719-32-6 (retrieved 2024-11-21) (CAS RN: 2719-32-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    121 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H4N2S/c9-5-7-1-3-8(4-2-7)10-6-11/h1-4H

InChIKey

InChIKey=DZFKAXLNKZXNHD-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzonitrile, 4-isothiocyanato-
  • Isothiocyanic acid, p-cyanophenyl ester
  • 4-Isothiocyanatobenzonitrile
  • p-Cyanophenyl isothiocyanate
  • 4-Cyanophenyl isothiocyanate

Deleted or Replaced CAS Registry Numbers

28176-29-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration