3alpha-(Acetyloxy)Cholan-24-Oic Acid Methyl Ester
[CAS# 56085-36-0]

Identification

• Name: 3alpha-(Acetyloxy)Cholan-24-Oic Acid Methyl Ester
• Synonyms: Methyl 4-(3-Acetoxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanoate; 4-(3-Acetoxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanoic Acid Methyl Ester; 4-(3-Acetoxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Valeric Acid Methyl Ester
• Molecular Formula: C₂₇H₄₄O₄
• Molecular Weight: 432.64
• CAS Registry Number: 56085-36-0
• SMILES: C(C(C4C3(C(C1C(C2(C(CC1)CC(OC(=O)C)CC2)C)CC3)CC4)C)C)CC(OC)=O
• InChI: 1S/C27H44O4/c1-17(6-11-25(29)30-5)22-9-10-23-21-8-7-19-16-20(31-18(2)28)12-14-26(19,3)24(21)13-15-27(22,23)4/h17,19-24H,6-16H2,1-5H3
• InChIKey: DVIUCIPCTDVQAP-UHFFFAOYSA-N

Properties

• Density: 1.064g/cm³ (Cal.)
• Boiling point: 487.482°C at 760 mmHg (Cal.)
• Flash point: 230.679°C (Cal.)