S-(3-Chloropropyl) ethanethioate

CAS Registry Number®

13012-54-9

CAS Name

S-(3-Chloropropyl) ethanethioate

Molecular Formula

C5H9ClOS

Molecular Mass

152.64

Cite this Page

S-(3-Chloropropyl) ethanethioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13012-54-9 (retrieved 2024-11-22) (CAS RN: 13012-54-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    83-84 °C @ Press: 10 Torr

  • Density (1)

    1.1589 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5H9ClOS/c1-5(7)8-4-2-3-6/h2-4H2,1H3

InChIKey

InChIKey=IOLUCUQNAZTKMN-UHFFFAOYSA-N

SMILES

S(CCCCl)C(C)=O

Canonical SMILES

O=C(SCCCCl)C

Other Names for this Substance

  • Ethanethioic acid, S-(3-chloropropyl) ester
  • Acetic acid, thio-, S-(3-chloropropyl) ester
  • 1-Propanethiol, 3-chloro-, acetate
  • S-(3-Chloropropyl) ethanethioate
  • NSC 163141

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