2-Isothiocyanato-1,3-dimethylbenzene

CAS Registry Number®

19241-16-8

CAS Name

2-Isothiocyanato-1,3-dimethylbenzene

Molecular Formula

C9H9NS

Molecular Mass

163.24

Cite this Page

2-Isothiocyanato-1,3-dimethylbenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19241-16-8 (retrieved 2024-11-24) (CAS RN: 19241-16-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    89 °C @ Press: 2 Torr

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=UULUECCNPPJFBU-UHFFFAOYSA-N

SMILES

N(=C=S)C1=C(C)C=CC=C1C

Canonical SMILES

S=C=NC=1C(=CC=CC1C)C

Other Names for this Substance

  • Benzene, 2-isothiocyanato-1,3-dimethyl-
  • Isothiocyanic acid, 2,6-xylyl ester
  • 2-Isothiocyanato-1,3-dimethylbenzene
  • 2,6-Dimethylphenyl isothiocyanate
  • 2,6-Xylyl isothiocyanate

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