4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile

CAS Registry Number®

57021-54-2
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CAS Name

4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile

Molecular Formula

C9H9NS

Molecular Mass

163.24

Cite this Page

4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57021-54-2 (retrieved 2024-08-01) (CAS RN: 57021-54-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    147 °C @ Press: 2.6 Torr

  • Melting Point (1)

    38 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C9H9NS/c10-6-8-5-7-3-1-2-4-9(7)11-8/h5H,1-4H2

InChIKey

InChIKey=IOQNRXMIUGPZRP-UHFFFAOYSA-N

SMILES

C(#N)C1=CC2=C(S1)CCCC2

Canonical SMILES

N#CC=1SC2=C(C1)CCCC2

Other Names for this Substance

  • Benzo[b]thiophene-2-carbonitrile, 4,5,6,7-tetrahydro-
  • 4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carbonitrile