5alpha-Cholestan-6-One
[CAS# 570-46-7]

Identification

• Name: 5alpha-Cholestan-6-One
• Synonyms: 17-(1,5-Dimethylhexyl)-10,13-Dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-6-One; Cholestan-6-One; 5.Beta.-Cholestan-6-One
• Molecular Formula: C₂₇H₄₆O
• Molecular Weight: 386.66
• CAS Registry Number: 570-46-7
• SMILES: C(C(C4C1(C)C(C2C(CC1)C3(C)C(C(C2)=O)CCCC3)CC4)C)CCC(C)C
• InChI: 1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25(28)24-11-6-7-15-26(24,4)23(20)14-16-27(21,22)5/h18-24H,6-17H2,1-5H3
• InChIKey: WSSZZUWWCXSGKJ-UHFFFAOYSA-N

Properties

• Density: 0.953g/cm³ (Cal.)
• Boiling point: 452.886°C at 760 mmHg (Cal.)
• Flash point: 219.293°C (Cal.)