1-Hexanethiol, 96%, ACROS Organics™

Product Code	Brand	Quantity	Packaging
10012930	Acros Organics 215270050	5mL	Glass bottle
10676992	Acros Organics 215271000	100mL	Glass bottle
10046103	Acros Organics 215275000	500mL	Glass bottle

Chemical Identifiers

• CAS: 111-31-9
• Molecular Weight (g/mol): 118.24
• InChI Key: PMBXCGGQNSVESQ-UHFFFAOYSA-N
• PubChem CID: 8106
• SMILES: CCCCCCS

• Molecular Formula: C₆H₁₄S
• MDL Number: MFCD00004909
• Synonym: 1-hexanethiol, hexyl mercaptan, n-hexyl mercaptan, hexanethiol, 1-hexylthiol, 1-mercaptohexane, hexylthiol, n-hexanethiol, n-hexylthiol, n-hexylmercaptan
• IUPAC Name: hexane-1-thiol

Specifications

• Chemical Name or Material: 1-Hexanethiol
• Flash Point: 30°C
• Packaging: Glass bottle
• Specific Gravity: 0.84
• Color: Colorless to Yellow
• Quantity: 5mL
• CAS Min %: 95.0
• Assay Percent Range: 95% min. (GC)
• Linear Formula: CH₃(CH₂)₅SH
• Beilstein: 01, 408
• Solubility Information: Solubility in water: insoluble. Other solubilities: soluble in alcohols, ethyl ether, hydrocarbons
• SMILES: CCCCCCS
• Molecular Weight (g/mol): 118.24
• Formula Weight: 118.24
• Percent Purity: 96%

• Density: 0.8400g/mL
• Infrared Spectrum: Authentic
• Refractive Index: 1.4470 to 1.4510
• Boiling Point: 150.0°C to 154.0°C
• Melting Point: -81°C to 80°C
• CAS: 111-31-9
• CAS Max %: 100.0
• Molecular Formula: C₆H₁₄S
• MDL Number: MFCD00004909
• Synonym: 1-hexanethiol, hexyl mercaptan, n-hexyl mercaptan, hexanethiol, 1-hexylthiol, 1-mercaptohexane, hexylthiol, n-hexanethiol, n-hexylthiol, n-hexylmercaptan
• InChI Key: PMBXCGGQNSVESQ-UHFFFAOYSA-N
• IUPAC Name: hexane-1-thiol
• PubChem CID: 8106
• Physical Form: Liquid