4-(Methylthio)phenyl isocyanate

CAS Registry Number®

1632-84-4

CAS Name

4-(Methylthio)phenyl isocyanate

Molecular Formula

C8H7NOS

Molecular Mass

165.21

Cite this Page

4-(Methylthio)phenyl isocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1632-84-4 (retrieved 2024-11-24) (CAS RN: 1632-84-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    117-118 °C @ Press: 8 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H7NOS/c1-11-8-4-2-7(3-5-8)9-6-10/h2-5H,1H3

InChIKey

InChIKey=QNKQBDZVEKZFBN-UHFFFAOYSA-N

SMILES

N(=C=O)C1=CC=C(SC)C=C1

Canonical SMILES

O=C=NC1=CC=C(SC)C=C1

Other Names for this Substance

  • Benzene, 1-isocyanato-4-(methylthio)-
  • Isocyanic acid, p-(methylthio)phenyl ester
  • Sulfide, p-isocyanatophenyl methyl
  • 1-Isocyanato-4-(methylthio)benzene
  • 4-(Methylthio)phenyl isocyanate

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