2,8-Epithio-p-menthane

• Catalog Number: ACM68398185
• Product Name: 2,8-Epithio-p-menthane
• CAS: 68398-18-5
• Category: Heterocyclic Organic Compound
• Synonyms: Zestoril
• IUPAC Name: 4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane
• Molecular Weight: 170.32
• Molecular Formula: C₁₀H₁₈S
• Canonical SMILES: CC1CCC2CC1SC2(C)C
• InChI: InChI=1S/C10H18S/c1-7-4-5-8-6-9(7)11-10(8,2)3/h7-9H,4-6H2,1-3H3
• InChI Key: FAXNZPOZWCWYBD-UHFFFAOYSA-N
• Boiling Point: 222.7±9.0 °C
• Flash Point: 79ºC
• Density: 0.941±0.06 g/cm³
• Solubility: Insoluble in water
• EC Number: 269-970-2
• Exact Mass: 170.11292175
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Monoisotopic Mass: 170.11292175
• Odor: Earthy, citrus aroma
• Physical State: Liquid
• Refractive Index: n20/D1.513-1.521(lit.)
• Topological Polar Surface Area: 25.3 Ų