Benzo[b]thiophene-3-acetonitrile

CAS Registry Number®

3216-48-6

CAS Name

Benzo[b]thiophene-3-acetonitrile

Molecular Formula

C10H7NS

Molecular Mass

173.23

Cite this Page

Benzo[b]thiophene-3-acetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3216-48-6 (retrieved 2024-11-25) (CAS RN: 3216-48-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    138-140 °C @ Press: 2 Torr

  • Melting Point (1)

    66-67 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H7NS/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7H,5H2

InChIKey

InChIKey=DEELHLMCCWZFFE-UHFFFAOYSA-N

SMILES

C(C#N)C=1C=2C(SC1)=CC=CC2

Canonical SMILES

N#CCC1=CSC=2C=CC=CC21

Other Names for this Substance

  • Benzo[b]thiophene-3-acetonitrile
  • 3-Benzothienylacetonitrile
  • 3-Benzothiopheneacetonitrile
  • 3-(Cyanomethyl)benzo[b]thiophene
  • NSC 332302

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