19-Hydroxycholesterol 3-Acetate
[CAS# 750-59-4]

Identification

• Name: 19-Hydroxycholesterol 3-Acetate
• Synonyms: [17-(1,5-Dimethylhexyl)-10-(Hydroxymethyl)-13-Methyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Acetate; Acetic Acid [17-(1,5-Dimethylhexyl)-10-(Hydroxymethyl)-13-Methyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [17-(1,5-Dimethylhexyl)-13-Methyl-10-Methylol-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester
• Molecular Formula: C₂₉H₄₈O₃
• Molecular Weight: 444.70
• CAS Registry Number: 750-59-4
• SMILES: C(C34C2C(C1C(C(C(CCCC(C)C)C)CC1)(C)CC2)CC=C3CC(OC(C)=O)CC4)O
• InChI: 1S/C29H48O3/c1-19(2)7-6-8-20(3)25-11-12-26-24-10-9-22-17-23(32-21(4)31)13-16-29(22,18-30)27(24)14-15-28(25,26)5/h9,19-20,23-27,30H,6-8,10-18H2,1-5H3
• InChIKey: ZUYKAEVLUWUNMD-UHFFFAOYSA-N

Properties

• Density: 1.043g/cm³ (Cal.)
• Boiling point: 529.906°C at 760 mmHg (Cal.)
• Flash point: 195.421°C (Cal.)