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Allopregnandiol
[CAS# 516-53-0]

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Identification
Name Allopregnandiol
Synonyms Zinc04081539; (20R)-5Alpha-Pregnane-3Beta,20-Diol
Molecular Structure CAS#: 516-53-0, Allopregnandiol
Molecular Formula C21H36O2
Molecular Weight 320.51
CAS Registry Number 516-53-0
EINECS 208-223-7
SMILES [C@]24([C@H]([C@@H]1CC[C@@H]3[C@@]([C@H]1CC2)(CC[C@H](O)C3)C)CC[C@@H]4[C@H](O)C)C
InChI 1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13-,14+,15+,16+,17-,18+,19+,20+,21-/m1/s1
InChIKey YWYQTGBBEZQBGO-XFHAOOBSSA-N
Properties
Density 1.054g/cm3 (Cal.)
Boiling point 435.91°C at 760 mmHg (Cal.)
Flash point 191.009°C (Cal.)
Market Analysis Reports
List of Reports Available for Allopregnandiol
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