Isoprothiolane

CAS Registry Number®

50512-35-1
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CAS Name

Isoprothiolane

Molecular Formula

C12H18O4S2

Molecular Mass

290.40

Cite this Page

Isoprothiolane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=50512-35-1 (retrieved 2024-04-28) (CAS RN: 50512-35-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    168 °C

  • Melting Point (1)

    54 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C12H18O4S2/c1-7(2)15-10(13)9(11(14)16-8(3)4)12-17-5-6-18-12/h7-8H,5-6H2,1-4H3

InChIKey

InChIKey=UFHLMYOGRXOCSL-UHFFFAOYSA-N

SMILES

C(C(OC(C)C)=O)(C(OC(C)C)=O)=C1SCCS1

Canonical SMILES

O=C(OC(C)C)C(C(=O)OC(C)C)=C1SCCS1

Other Names for this Substance

  • Propanedioic acid, 2-(1,3-dithiolan-2-ylidene)-, 1,3-bis(1-methylethyl) ester
  • Propanedioic acid, 1,3-dithiolan-2-ylidene-, bis(1-methylethyl) ester
  • NNF 109
  • Diisopropyl 1,3-dithiolan-2-ylidenemalonate
  • IPT

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Deleted or Replaced CAS Registry Numbers

1135443-34-3

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