2-(2-Isothiocyanatoethyl)thiophene

CAS Registry Number®

40808-63-7

CAS Name

2-(2-Isothiocyanatoethyl)thiophene

Molecular Formula

C7H7NS2

Molecular Mass

169.27

Cite this Page

2-(2-Isothiocyanatoethyl)thiophene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40808-63-7 (retrieved 2024-11-30) (CAS RN: 40808-63-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    110 °C @ Press: 1 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C7H7NS2/c9-6-8-4-3-7-2-1-5-10-7/h1-2,5H,3-4H2

InChIKey

InChIKey=FWEHLMFQLWSMTH-UHFFFAOYSA-N

SMILES

C(CN=C=S)C1=CC=CS1

Canonical SMILES

S=C=NCCC=1SC=CC1

Other Names for this Substance

  • Thiophene, 2-(2-isothiocyanatoethyl)-
  • 2-(2-Isothiocyanatoethyl)thiophene
  • 2-(2-Thienyl)ethyl isothiocyanate

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