(1S,2S,5S)-5-Isopropenyl-2-methylcyclohexyl propionate
[CAS# 71662-22-1]

Identification

• Name: (1S,2S,5S)-5-Isopropenyl-2-methylcyclohexyl propionate
• Synonyms: (1α,2β,5α)-2-methyl-5-(1-methylvinyl)cyclohexyl propionate
• Molecular Formula: C₁₃H₂₂O₂
• Molecular Weight: 210.31
• CAS Registry Number: 71662-22-1
• EINECS: 275-787-9
• SMILES: O=C(O[C@H]1C[C@H](CC[C@@H]1C)C(C)=C)CC
• InChI: 1S/C13H22O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h10-12H,2,5-8H2,1,3-4H3/t10-,11-,12-/m0/s1
• InChIKey: HWOVQMSYUZIVEB-SRVKXCTJSA-N

Properties

• Density: 0.935g/cm³ (Cal.)
• Boiling point: 260.876°C at 760 mmHg (Cal.)
• Flash point: 103.298°C (Cal.)