2,6,6-Trimethyl-2-Cyclohexene-1-Methanethiol
[CAS# 71820-48-9]

Identification

• Name: 2,6,6-Trimethyl-2-Cyclohexene-1-Methanethiol
• Synonyms: 2-Cyclohexene-1-Methanethiol, 2,6,6-Trimethyl-; Cyclogeranyl Mercaptan
• Molecular Formula: C₁₀H₁₈S
• Molecular Weight: 170.31
• CAS Registry Number: 71820-48-9
• SMILES: [C@H]1(CS)C(=CCCC1(C)C)C
• InChI: 1S/C10H18S/c1-8-5-4-6-10(2,3)9(8)7-11/h5,9,11H,4,6-7H2,1-3H3/t9-/m0/s1
• InChIKey: AVZCLGHLTWUBHI-VIFPVBQESA-N

Properties

• Density: 0.89g/cm³ (Cal.)
• Boiling point: 223.248°C at 760 mmHg (Cal.)
• Flash point: 87.973°C (Cal.)