3-Hydroxy-3,6-Dimethyl-2,3,3,4,5,8,9,10,10,11,11,11-Dodecahydro-1H-Cyclopenta(a)Anthracene-8-One
[CAS# 120542-29-2]

Identification

• Name: 3-Hydroxy-3,6-Dimethyl-2,3,3,4,5,8,9,10,10,11,11,11-Dodecahydro-1H-Cyclopenta(a)Anthracene-8-One
• Synonyms: Anthrasteroid 1; 1,6-Cyclo-1,10-Secoandrosta-4,9-Dien-3-One, 17-Hydroxy-, (6Beta,17Beta)-; 3-Hydroxy-3,6-Dimethyl-2,3,3,4,5,8,9,10,10,11,11,11-Dodecahydro-1H-Cyclopenta(A)Anthracene-8-One
• Molecular Formula: C₁₉H₂₆O₂
• Molecular Weight: 286.41
• CAS Registry Number: 120542-29-2
• SMILES: [C@@H]12CCC(C=C1C(=C4[C@@H](C2)[C@@H]3CC[C@@H]([C@@]3(C)CC4)O)C)=O
• InChI: 1S/C19H26O2/c1-11-14-7-8-19(2)17(5-6-18(19)21)16(14)9-12-3-4-13(20)10-15(11)12/h10,12,16-18,21H,3-9H2,1-2H3/t12-,16+,17-,18-,19-/m0/s1
• InChIKey: HGULMTJPHPUFCN-WKCWRMMGSA-N

Properties

• Density: 1.148g/cm³ (Cal.)
• Boiling point: 460.699°C at 760 mmHg (Cal.)
• Flash point: 196.082°C (Cal.)