4-Bromo-1-isothiocyanato-2-methylbenzene

CAS Registry Number®

19241-38-4

CAS Name

4-Bromo-1-isothiocyanato-2-methylbenzene

Molecular Formula

C8H6BrNS

Molecular Mass

228.11

Cite this Page

4-Bromo-1-isothiocyanato-2-methylbenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19241-38-4 (retrieved 2024-11-24) (CAS RN: 19241-38-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    50-51 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6BrNS/c1-6-4-7(9)2-3-8(6)10-5-11/h2-4H,1H3

InChIKey

InChIKey=YASXCQRGYJGIKD-UHFFFAOYSA-N

SMILES

N(=C=S)C1=C(C)C=C(Br)C=C1

Canonical SMILES

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

Other Names for this Substance

  • Benzene, 4-bromo-1-isothiocyanato-2-methyl-
  • Isothiocyanic acid, 4-bromo-o-tolyl ester
  • 4-Bromo-1-isothiocyanato-2-methylbenzene
  • 4-Bromo-2-methylphenyl isothiocyanate

CAS INSIGHTSTM
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