(17alpha )-4,17-Dimethyl-18,19-Dinorcholesta-1,3,5,7,9,11,13-Heptaene
[CAS# 80382-25-8]

Identification

• Name: (17alpha )-4,17-Dimethyl-18,19-Dinorcholesta-1,3,5,7,9,11,13-Heptaene
• Synonyms: (17R)-17-[(1R)-1,5-Dimethylhexyl]-4,17-Dimethyl-15,16-Dihydrocyclopenta[A]Phenanthrene; 18,19-Dinorcholesta-1,3,5,7,9,11,13-Heptaene, 4,17-Dimethyl-, (17Alpha)-
• Molecular Formula: C₂₇H₃₄
• Molecular Weight: 358.57
• CAS Registry Number: 80382-25-8
• SMILES: [C@]1(CCC3=C1C=CC4=C2C=CC=C(C2=CC=C34)C)([C@@H](CCCC(C)C)C)C
• InChI: 1S/C27H34/c1-18(2)8-6-10-20(4)27(5)17-16-25-24-13-12-21-19(3)9-7-11-22(21)23(24)14-15-26(25)27/h7,9,11-15,18,20H,6,8,10,16-17H2,1-5H3/t20-,27-/m1/s1
• InChIKey: KUPQKNLBQPAEEE-NFQMXDRXSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 492.422°C at 760 mmHg (Cal.)
• Flash point: 251.931°C (Cal.)