Pregnane-3,20-diol, (3a,5b,20S)-


Chemical Name: Pregnane-3,20-diol, (3a,5b,20S)-
CAS Number: 80-92-2
Product Number: AG003472(AGN-PC-0OIGNG)
Synonyms:
MDL No:
Molecular Formula: C21H36O2
Molecular Weight: 320.5093

Identification/Properties


Properties
MP:
236-239˚C
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
320.517g/mol
XLogP3:
5.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
320.272g/mol
Monoisotopic Mass:
320.272g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
463
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
9
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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