(3S,8R,9S,10R,13S,14S,17S)-17-(Bis(2-Hydroxyethyl)Amino)-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Ol
[CAS# 6956-93-0]

Identification

• Name: (3S,8R,9S,10R,13S,14S,17S)-17-(Bis(2-Hydroxyethyl)Amino)-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Ol
• Synonyms: Nsc69298; 17Beta-[Bis(2-Hydroxyethyl)Amino]Androst-5-En-3Beta-Ol; C14966
• Molecular Formula: C₂₃H₃₉NO₃
• Molecular Weight: 377.57
• CAS Registry Number: 6956-93-0
• SMILES: [C@H]1(N(CCO)CCO)CC[C@@H]2[C@]1(C)CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C
• InChI: 1S/C23H39NO3/c1-22-9-7-17(27)15-16(22)3-4-18-19-5-6-21(24(11-13-25)12-14-26)23(19,2)10-8-20(18)22/h3,17-21,25-27H,4-15H2,1-2H3/t17-,18-,19-,20-,21-,22-,23-/m0/s1
• InChIKey: IEQZBQLFRAVFHT-FQJIPJFPSA-N

Properties

• Density: 1.156g/cm³ (Cal.)
• Boiling point: 550.662°C at 760 mmHg (Cal.)
• Flash point: 277.735°C (Cal.)