Molecule record

propane-1-thiol

C3H8S

76.16 g/mol

Loading structure

Molecular properties

Formula
C3H8S
Molar mass
76.16 g·mol−1
Exact mass
76.0347 Da
0
PubChem CID
7848

Functional groups

Alkane / alkyl carbon
Thiol

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-Mercaptopropane
  • 1-Propanethiol
  • 1-Propyl mercaptan
  • 1-Propylmercaptan
  • 1-propylthiol
  • 107-03-9
  • 4AB0N08V2H
  • 79869-58-2
Show all 24 synonyms
  • BRN 1696860
  • CCRIS 1246
  • DTXSID5026750
  • EINECS 203-455-5
  • FEMA No. 3521
  • HSDB 1037
  • PROPYL MERCAPTAN
  • Propanethiol
  • Propanethiols
  • Propylthiol
  • Thiopropyl alcohol
  • n-Propyl mercaptan
  • n-Propylmercaptan
  • n-Propylthiol
  • n-Thiopropyl alcohol
  • n-propanethiol

Structure identifiers

Canonical SMILES
CCCS
Isomeric SMILES
CCCS
InChI
InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3
InChIKey
SUVIGLJNEAMWEG-UHFFFAOYSA-N
PubChem CID
7848

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for propane-1-thiol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for propane-1-thiol; not experimental data.

Sources

Molecule identity

Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record