(3aR,4S,5aS,8aR)-4-Methylhexahydrocyclopenta[c]pentalene-3a,5a(1H,6H)-diol
[CAS# 697286-79-6]

Identification

• Name: (3aR,4S,5aS,8aR)-4-Methylhexahydrocyclopenta[c]pentalene-3a,5a(1H,6H)-diol
• Synonyms: (3aR,4S,5aS,8aR)-4-methyldecahydrocyclopenta[c]pentalene-3a,5a-diol
• Molecular Formula: C₁₂H₂₀O₂
• Molecular Weight: 196.29
• CAS Registry Number: 697286-79-6
• SMILES: C[C@H]1C[C@]2(CCC[C@]23[C@]1(CCC3)O)O
• InChI: 1S/C12H20O2/c1-9-8-11(13)6-2-4-10(11)5-3-7-12(9,10)14/h9,13-14H,2-8H2,1H3/t9-,10+,11-,12+/m0/s1
• InChIKey: PCYBHMGGXJHGDE-WHOHXGKFSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 305.0±10.0°C at 760 mmHg (Cal.)
• Flash point: 142.5±13.6°C (Cal.)
• Refractive index: 1.565 (Cal.)