4-(1,2,3-Thiadiazol-4-yl)benzonitrile

CAS Registry Number®

82894-99-3

CAS Name

4-(1,2,3-Thiadiazol-4-yl)benzonitrile

Molecular Formula

C9H5N3S

Molecular Mass

187.22

Cite this Page

4-(1,2,3-Thiadiazol-4-yl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=82894-99-3 (retrieved 2024-11-24) (CAS RN: 82894-99-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    157-158 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H5N3S/c10-5-7-1-3-8(4-2-7)9-6-13-12-11-9/h1-4,6H

InChIKey

InChIKey=LOLQDXFKXGCNFZ-UHFFFAOYSA-N

SMILES

C(#N)C1=CC=C(C=C1)C2=CSN=N2

Canonical SMILES

N#CC1=CC=C(C=C1)C=2N=NSC2

Other Names for this Substance

  • Benzonitrile, 4-(1,2,3-thiadiazol-4-yl)-
  • 1,2,3-Thiadiazole, benzonitrile deriv.
  • 4-(1,2,3-Thiadiazol-4-yl)benzonitrile
  • 4-(p-Cyanophenyl)-1,2,3-thiadiazole

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