3-Bromophenyl isothiocyanate

CAS Registry Number®

2131-59-1

CAS Name

3-Bromophenyl isothiocyanate

Molecular Formula

C7H4BrNS

Molecular Mass

214.08

Cite this Page

3-Bromophenyl isothiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2131-59-1 (retrieved 2024-11-22) (CAS RN: 2131-59-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    256 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C7H4BrNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H

InChIKey

InChIKey=ZMGMGHNOACSMQN-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

S=C=NC=1C=CC=C(Br)C1

Other Names for this Substance

  • Benzene, 1-bromo-3-isothiocyanato-
  • Isothiocyanic acid, m-bromophenyl ester
  • 1-Bromo-3-isothiocyanatobenzene
  • m-Bromophenyl isothiocyanate
  • 3-Bromophenyl isothiocyanate

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration