1-(2-Thienyl)-1,3-butanedione

CAS Registry Number®

3051-27-2
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CAS Name

1-(2-Thienyl)-1,3-butanedione

Molecular Formula

C8H8O2S

Molecular Mass

168.21

Cite this Page

1-(2-Thienyl)-1,3-butanedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3051-27-2 (retrieved 2024-07-06) (CAS RN: 3051-27-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    129-131 °C @ Press: 8 Torr

  • Melting Point (2)

    34 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H8O2S/c1-6(9)5-7(10)8-3-2-4-11-8/h2-4H,5H2,1H3

InChIKey

InChIKey=BSXCLFYNJYBVPM-UHFFFAOYSA-N

SMILES

C(CC(C)=O)(=O)C1=CC=CS1

Canonical SMILES

O=C(C=1SC=CC1)CC(=O)C

Other Names for this Substance

  • 1,3-Butanedione, 1-(2-thienyl)-
  • 1-(2-Thienyl)-1,3-butanedione
  • 2-Thenoylacetone
  • Thenoylacetone
  • NSC 80371

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