3-(Octylthio)propanoic acid

CAS Registry Number®

6964-23-4

CAS Name

3-(Octylthio)propanoic acid

Molecular Formula

C11H22O2S

Molecular Mass

218.36

Cite this Page

3-(Octylthio)propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6964-23-4 (retrieved 2024-12-23) (CAS RN: 6964-23-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    40-41 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H22O2S/c1-2-3-4-5-6-7-9-14-10-8-11(12)13/h2-10H2,1H3,(H,12,13)

InChIKey

InChIKey=OIXUWMYLRUBAHK-UHFFFAOYSA-N

SMILES

S(CCCCCCCC)CCC(O)=O

Canonical SMILES

O=C(O)CCSCCCCCCCC

Other Names for this Substance

  • Propanoic acid, 3-(octylthio)-
  • Propionic acid, 3-(octylthio)-
  • 3-(Octylthio)propanoic acid
  • 3-(Octylthio)propionic acid
  • NSC 66313

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