Cholest-5-En-3beta-Yl Isovalerate
[CAS# 41328-97-6]

Identification

• Name: Cholest-5-En-3beta-Yl Isovalerate
• Synonyms: [(3S,10R,13R,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] 3-Methylbutanoate; 3-Methylbutanoic Acid [(3S,10R,13R,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] Ester; 3-Methylbutyric Acid [(3S,10R,13R,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] Ester
• Molecular Formula: C₃₂H₅₄O₂
• Molecular Weight: 470.78
• CAS Registry Number: 41328-97-6
• EINECS: 255-315-8
• SMILES: [C@]14([C@H](CCC1C2C([C@@]3(C(=CC2)C[C@@H](OC(=O)CC(C)C)CC3)C)CC4)[C@@H](CCCC(C)C)C)C
• InChI: 1S/C32H54O2/c1-21(2)9-8-10-23(5)27-13-14-28-26-12-11-24-20-25(34-30(33)19-22(3)4)15-17-31(24,6)29(26)16-18-32(27,28)7/h11,21-23,25-29H,8-10,12-20H2,1-7H3/t23-,25+,26?,27-,28?,29?,31+,32-/m1/s1
• InChIKey: HWVAWHHNNDOXDU-PNJUYXLKSA-N

Properties

• Density: 0.984g/cm³ (Cal.)
• Boiling point: 526.622°C at 760 mmHg (Cal.)
• Flash point: 269.687°C (Cal.)