1-Hexanethiol
CAS Registry Number®
111-31-9
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CAS Name
1-HexanethiolMolecular Formula
C6H14SMolecular Mass
118.24Cite this Page
1-Hexanethiol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=111-31-9 (retrieved ) (CAS RN: 111-31-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
151 °CMelting Point (1)
-81 °CDensity (2)
0.8367 g/cm³ @ Temp: 25 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) GB577279, 1946, CAplus
Other Names and Identifiers
InChI
InChI=1S/C6H14S/c1-2-3-4-5-6-7/h7H,2-6H2,1H3
InChIKey
InChIKey=PMBXCGGQNSVESQ-UHFFFAOYSA-N
SMILES
C(CCC)CCS
Canonical SMILES
SCCCCCC
Other Names for this Substance
- 1-Hexanethiol
- Hexanethiol
- Hexyl mercaptan
- Hexan-1-thiol
- n-Hexyl mercaptan
Deleted or Replaced CAS Registry Numbers
2022216-71-1
