(3beta,5alpha)-3-Hydroxycholestan-7-one
[CAS# 7591-17-5]

Identification

• Name: (3beta,5alpha)-3-Hydroxycholestan-7-one
• Synonyms: 7-KETOCHOLESTANOL
• Molecular Formula: C₂₇H₄₆O₂
• Molecular Weight: 402.65
• CAS Registry Number: 7591-17-5
• SMILES: O=C1C[C@H]4C[C@@H](O)CC[C@@]4([C@H]2CC[C@@]3(C)[C@H]([C@H]12)CC[C@@H]3[C@H](C)CCCC(C)C)C
• InChI: 1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h17-23,25,28H,6-16H2,1-5H3/t18-,19-,20+,21-,22+,23+,25+,26+,27-/m1/s1
• InChIKey: QIHXSWPLWOYYST-WIQRBZPFSA-N

Properties

• Density: 1g/cm³ (Cal.)
• Boiling point: 501.285°C at 760 mmHg (Cal.)
• Flash point: 212.398°C (Cal.)