4-Isothiocyanato-1,2-dimethylbenzene

CAS Registry Number®

19241-17-9

CAS Name

4-Isothiocyanato-1,2-dimethylbenzene

Molecular Formula

C9H9NS

Molecular Mass

163.24

Cite this Page

4-Isothiocyanato-1,2-dimethylbenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19241-17-9 (retrieved 2024-11-24) (CAS RN: 19241-17-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    263-264 °C

  • Melting Point (2)

    74-76 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NS/c1-7-3-4-9(10-6-11)5-8(7)2/h3-5H,1-2H3

InChIKey

InChIKey=JFSHJWKBNJMGOK-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

S=C=NC1=CC=C(C(=C1)C)C

Other Names for this Substance

  • Benzene, 4-isothiocyanato-1,2-dimethyl-
  • Isothiocyanic acid, 3,4-xylyl ester
  • 4-Isothiocyanato-1,2-dimethylbenzene
  • 3,4-Dimethylphenyl isothiocyanate

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