1-Ethyl-2-isothiocyanatobenzene

CAS Registry Number®

19241-19-1

CAS Name

1-Ethyl-2-isothiocyanatobenzene

Molecular Formula

C9H9NS

Molecular Mass

163.24

Cite this Page

1-Ethyl-2-isothiocyanatobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19241-19-1 (retrieved 2024-11-21) (CAS RN: 19241-19-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    254-255 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NS/c1-2-8-5-3-4-6-9(8)10-7-11/h3-6H,2H2,1H3

InChIKey

InChIKey=OVAFDUCMHLFDIG-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

S=C=NC=1C=CC=CC1CC

Other Names for this Substance

  • Benzene, 1-ethyl-2-isothiocyanato-
  • Isothiocyanic acid, o-ethylphenyl ester
  • 1-Ethyl-2-isothiocyanatobenzene
  • 2-Ethylphenyl isothiocyanate
  • o-Ethylphenyl isothiocyanate

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration