(1R,5S)-5-(2-Hydroxy-2-Propanyl)-2-Methyl-2-Cyclohexen-1-Ol
[CAS# 38235-58-4]

Identification

• Name: (1R,5S)-5-(2-Hydroxy-2-Propanyl)-2-Methyl-2-Cyclohexen-1-Ol
• Synonyms: (1S-trans)-5-hydroxy-α,α,4-trimethylcyclohex-3-ene-1-methanol
• Molecular Formula: C₁₀H₁₈O₂
• Molecular Weight: 170.25
• CAS Registry Number: 38235-58-4
• EINECS: 253-844-9
• SMILES: CC1=CC[C@@H](C[C@H]1O)C(C)(C)O
• InChI: 1S/C10H18O2/c1-7-4-5-8(6-9(7)11)10(2,3)12/h4,8-9,11-12H,5-6H2,1-3H3/t8-,9+/m0/s1
• InChIKey: OMDMTHRBGUBUCO-DTWKUNHWSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 270.499°C at 760 mmHg (Cal.)
• Flash point: 120.9±18.6°C (Cal.)

References

• (1): Yong Yu, Michael J. Ezell, Alla Zelenyuk, Dan Imre, Liz Alexander, John Ortega, Jennie L. Thomas, Karun Gogna, Douglas J. Tobias, Barbara D'Anna, Chris W. Harmon, Stanley N. Johnson and Barbara J. Finlayson-Pitts. Nitrate ion photochemistry at interfaces: a new mechanism for oxidation of α-pinene, Phys. Chem. Chem. Phys., 2008, 10, 3063.