Benzene, 1,3-diisothiocyanato-2-methyl-

CAS Registry Number®

25642-63-1
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CAS Name

Benzene, 1,3-diisothiocyanato-2-methyl-

Molecular Formula

C9H6N2S2

Molecular Mass

206.29

Cite this Page

Benzene, 1,3-diisothiocyanato-2-methyl-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=25642-63-1 (retrieved 2024-04-28) (CAS RN: 25642-63-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6N2S2/c1-7-8(10-5-12)3-2-4-9(7)11-6-13/h2-4H,1H3

InChIKey

InChIKey=AZXFPXMWSWRZLF-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

S=C=NC1=CC=CC(N=C=S)=C1C

Other Names for this Substance

  • Benzene, 1,3-diisothiocyanato-2-methyl-
  • Isothiocyanic acid, 2-methyl-m-phenylene ester
  • Tolylene-2,6-diisothiocyanate
  • 1,3-Diisothiocyanato-2-methylbenzene

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