Phenyl isothiocyanate

CAS Registry Number®

103-72-0

CAS Name

Phenyl isothiocyanate

Molecular Formula

C7H5NS

Molecular Mass

135.19

Cite this Page

Phenyl isothiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=103-72-0 (retrieved 2024-11-22) (CAS RN: 103-72-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    221 °C

  • Melting Point (1)

    -21 °C

  • Density (2)

    1.13 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5H

InChIKey

InChIKey=QKFJKGMPGYROCL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

S=C=NC=1C=CC=CC1

Other Names for this Substance

  • Benzene, isothiocyanato-
  • Isothiocyanic acid, phenyl ester
  • Isothiocyanatobenzene
  • Phenyl isothiocyanate
  • Phenyl mustard oil

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Deleted or Replaced CAS Registry Numbers

2124236-45-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration