3-Ethyl-5a,5b,8,8,11a,13b-hexamethylicosahydro-1H-cyclopenta[a]chrysene
[CAS# 36728-72-0]

Identification

• Name: 3-Ethyl-5a,5b,8,8,11a,13b-hexamethylicosahydro-1H-cyclopenta[a]chrysene
• Synonyms: (17-Alpha)-A'-Neo-30-Norgammacerane; 28-Nor-17.Alpha.(H)-Hopane; 3-Ethyl-5A,5B,8,8,11A,13B-Hexamethylicosahydro-1H-Cyclopenta[A]Chrysene
• Molecular Formula: C₂₉H₅₀
• Molecular Weight: 398.71
• CAS Registry Number: 36728-72-0
• SMILES: C(C5C4C(C3C(C2(C(C1(C(C(CCC1)(C)C)CC2)C)CC3)C)(CC4)C)(CC5)C)C
• InChI: 1S/C29H50/c1-8-20-12-17-26(4)21(20)13-18-28(6)23(26)10-11-24-27(5)16-9-15-25(2,3)22(27)14-19-29(24,28)7/h20-24H,8-19H2,1-7H3
• InChIKey: XKJROQIFLGXWEY-UHFFFAOYSA-N

Properties

• Density: 0.924g/cm³ (Cal.)
• Boiling point: 447.646°C at 760 mmHg (Cal.)
• Flash point: 215.704°C (Cal.)