Ethyl isothiocyanate

CAS Registry Number®

542-85-8

CAS Name

Ethyl isothiocyanate

Molecular Formula

C3H5NS

Molecular Mass

87.14

Cite this Page

Ethyl isothiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=542-85-8 (retrieved 2024-11-22) (CAS RN: 542-85-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    131.5 °C

  • Melting Point (1)

    -5.9 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C3H5NS/c1-2-4-3-5/h2H2,1H3

InChIKey

InChIKey=HBNYJWAFDZLWRS-UHFFFAOYSA-N

SMILES

N(CC)=C=S

Canonical SMILES

S=C=NCC

Other Names for this Substance

  • Ethane, isothiocyanato-
  • Isothiocyanic acid, ethyl ester
  • Isothiocyanatoethane
  • Ethyl isothiocyanate
  • Ethyl mustard oil

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