Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,17-dihydroxy-, (11b)-


Chemical Name: Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,17-dihydroxy-, (11b)-
CAS Number: 50-03-3
Product Number: AG003QYO(AGN-PC-0OB5FR)
Synonyms:
MDL No:
Molecular Formula: C23H32O6
Molecular Weight: 404.4966

Identification/Properties


Properties
MP:
223 °C (dec.);(lit.);
BP:
576.6°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.4593 (estimate)
Computed Properties
Molecular Weight:
404.503g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
404.22g/mol
Monoisotopic Mass:
404.22g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
786
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
7
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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