Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate

CAS Registry Number®

4160-61-6

CAS Name

Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate

Molecular Formula

C7H10O3S

Molecular Mass

174.22

Cite this Page

Methyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4160-61-6 (retrieved 2024-11-24) (CAS RN: 4160-61-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    120 °C @ Press: 5 Torr

  • Density (2)

    1.2562 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H10O3S/c1-10-7(9)5-4-11-3-2-6(5)8/h5H,2-4H2,1H3

InChIKey

InChIKey=MCUXKFHPGMEIIW-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1C(=O)CCSC1

Canonical SMILES

O=C(OC)C1C(=O)CCSC1

Other Names for this Substance

  • 2H-Thiopyran-3-carboxylic acid, tetrahydro-4-oxo-, methyl ester
  • Thiopyran-3-carboxylic acid, tetrahydro-4-oxo-, methyl ester
  • Methyl tetrahydrothiopyran-4-one-3-carboxylate
  • 3-Carbomethoxytetrahydro-1,4-thiapyrone
  • 3-(Carbomethoxy)tetrahydrothiopyran-4-one

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Deleted or Replaced CAS Registry Numbers

92119-93-2

CAS INSIGHTSTM
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