Molecular properties
- Formula
- C3H8S
- Molar mass
- 76.16 g·mol−1
- Exact mass
- 76.0347 Da
- 0
- PubChem CID
- 6364
Molecule record
propane-2-thiol
C3H8S
76.16 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Thiol
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1Methylethanethiol
- 2-Propanethiol
- 2-Propylthiol
- 2Propylmercaptan
- 2mercaptopropane
- 2propanethiol
- AI3-22988
- CHEBI:8474
Show all 24 synonyms
- DTXCID105481
- DTXSID1025481
- E52LR62ETC
- EC 200-861-4
- EINECS 200-861-4
- FEMA NO. 3897
- HSDB 625
- ISOPROPYL MERCAPTAN
- ISOPROPYL MERCAPTAN [HSDB]
- NSC-87537
- Propanethiol-(2)
- RefChem:89143
- UN2402
- UNII-E52LR62ETC
- i-propylthiol
- iso-C3H7SH
Structure identifiers
- Canonical SMILES
- CC(C)S
- Isomeric SMILES
- CC(C)S
- InChI
- InChI=1S/C3H8S/c1-3(2)4/h3-4H,1-2H3
- InChIKey
- KJRCEJOSASVSRA-UHFFFAOYSA-N
- PubChem CID
- 6364
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for propane-2-thiol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for propane-2-thiol; not experimental data.
Sources
Molecule identity
Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.