S,S-Diethyl 1,3-benzenedicarbothioate

CAS Registry Number®

584-69-0
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CAS Name

S,S-Diethyl 1,3-benzenedicarbothioate

Molecular Formula

C12H14O2S2

Molecular Mass

254.37

Cite this Page

S,S-Diethyl 1,3-benzenedicarbothioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=584-69-0 (retrieved 2024-04-27) (CAS RN: 584-69-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    210-212 °C @ Press: 15 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H14O2S2/c1-3-15-11(13)9-6-5-7-10(8-9)12(14)16-4-2/h5-8H,3-4H2,1-2H3

InChIKey

InChIKey=DWGXUDUOJPYAOR-UHFFFAOYSA-N

SMILES

C(SCC)(=O)C1=CC(C(SCC)=O)=CC=C1

Canonical SMILES

O=C(SCC)C1=CC=CC(=C1)C(=O)SCC

Other Names for this Substance

  • 1,3-Benzenedicarbothioic acid, S,S-diethyl ester
  • Isophthalic acid, 1,3-dithio-, S,S-diethyl ester
  • S,S-Diethyl 1,3-benzenedicarbothioate
  • Diethyl dithiolisophthalate
  • 1,3-Dithioisophthalic acid S,S-diethyl ester

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