Cholesteryl Crotylcarbonate
[CAS# 62637-94-9]

Identification

• Name: Cholesteryl Crotylcarbonate
• Synonyms: But-2-Enyl [(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-Methylheptan-2-Yl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Carbonate; [(E)-But-2-Enyl] [(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Carbonate; But-2-Enyl [(3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Carbonate
• Molecular Formula: C₃₂H₅₂O₃
• Molecular Weight: 484.76
• CAS Registry Number: 62637-94-9
• SMILES: [C@@H]4(CC[C@]1(C(=CC[C@@H]2[C@@H]1CC[C@]3([C@H]2CC[C@@H]3[C@H](C)CCCC(C)C)C)C4)C)OC(OC\C=C\C)=O
• InChI: 1S/C32H52O3/c1-7-8-20-34-30(33)35-25-16-18-31(5)24(21-25)12-13-26-28-15-14-27(23(4)11-9-10-22(2)3)32(28,6)19-17-29(26)31/h7-8,12,22-23,25-29H,9-11,13-21H2,1-6H3/b8-7+/t23-,25+,26+,27-,28+,29+,31+,32-/m1/s1
• InChIKey: KSSQCJJMANBPQK-BLAWCXQSSA-N

Properties

• Density: 1.017g/cm³ (Cal.)
• Boiling point: 560.645°C at 760 mmHg (Cal.)
• Flash point: 142.927°C (Cal.)