1-Octanethiol

CAS Registry Number®

111-88-6

CAS Name

1-Octanethiol

Molecular Formula

C8H18S

Molecular Mass

146.29

Cite this Page

1-Octanethiol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=111-88-6 (retrieved 2024-11-21) (CAS RN: 111-88-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    86 °C @ Press: 15 Torr

  • Melting Point (1)

    -49.2 °C

  • Density (1)

    0.8433 g/cm³ @ Temp: 20 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C8H18S/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3

InChIKey

InChIKey=KZCOBXFFBQJQHH-UHFFFAOYSA-N

SMILES

C(CCCC)CCCS

Canonical SMILES

SCCCCCCCC

Other Names for this Substance

  • 1-Octanethiol
  • Octyl mercaptan
  • n-Octyl mercaptan
  • 1-Mercaptooctane
  • n-Octanethiol

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration