1-(2,6-Dimethylphenyl)-1,2-dihydro-5H-tetrazole-5-thione

CAS Registry Number®

80650-21-1

CAS Name

1-(2,6-Dimethylphenyl)-1,2-dihydro-5H-tetrazole-5-thione

Molecular Formula

C9H10N4S

Molecular Mass

206.27

Cite this Page

1-(2,6-Dimethylphenyl)-1,2-dihydro-5H-tetrazole-5-thione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80650-21-1 (retrieved 2024-11-23) (CAS RN: 80650-21-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    205 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H10N4S/c1-6-4-3-5-7(2)8(6)13-9(14)10-11-12-13/h3-5H,1-2H3,(H,10,12,14)

InChIKey

InChIKey=BPNGKLFVOMPRJQ-UHFFFAOYSA-N

SMILES

CC1=C(C(C)=CC=C1)N2C(=S)NN=N2

Canonical SMILES

S=C1NN=NN1C=2C(=CC=CC2C)C

Other Names for this Substance

  • 5H-Tetrazole-5-thione, 1-(2,6-dimethylphenyl)-1,2-dihydro-
  • 1-(2,6-Dimethylphenyl)-1,2-dihydro-5H-tetrazole-5-thione
  • 1-(2,6-Dimethylphenyl)-1H-tetrazole-5-thiol
  • 1-(2,6-Dimethylphenyl)-1H-1,2,3,4-tetrazole-5-thiol

CAS INSIGHTSTM
Hourglass and a clock