Coprostanol
[CAS# 360-68-9]

Identification

• Name: Coprostanol
• Synonyms: (3S,5R,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-Dimethylhexyl]-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; 5Beta-Cholestan-3Beta-Ol; Nsc18175
• Molecular Formula: C₂₇H₄₈O
• Molecular Weight: 388.68
• CAS Registry Number: 360-68-9
• EINECS: 206-638-8
• SMILES: [C@@]14(C)[C@H]([C@H]2[C@H](CC1)[C@]3(C)[C@H](CC2)C[C@H](CC3)O)CC[C@@H]4[C@@H](CCCC(C)C)C
• InChI: 1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1
• InChIKey: QYIXCDOBOSTCEI-NWKZBHTNSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 455.5±13.0°C at 760 mmHg (Cal.)
• Flash point: 190.7±12.3°C (Cal.)