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Dienogestrel  Structure

Dienogestrel

Chemical Properties

Melting point 210-2140C
alpha  D25 -290° (c = 0.5 in pyridine)
Boiling point 451.46°C (rough estimate)
Density  1.0899 (rough estimate)
refractive index  1.5614 (estimate)
storage temp.  2-8°C
solubility  Chloroform (Slightly), Pyridine (Slightly)
pka 13?+-.0.40(Predicted)
form  powder
color  white to beige
optical activity [α]/D -305 to -325°, c = 1 in dichloromethane
Merck  14,3106
InChI InChI=1/C20H25NO2/c1-19-8-6-16-15-5-3-14(22)12-13(15)2-4-17(16)18(19)7-9-20(19,23)10-11-21/h12,17-18,23H,2-10H2,1H3/t17-,18+,19+,20-/s3
InChIKey AZFLJNIPTRTECV-XAYGXGNENA-N
SMILES C[C@]12CCC3=C4CCC(=O)C=C4CC[C@@]3([H])[C@]1([H])CC[C@@]2(O)CC#N |&1:1,14,16,20,r|
CAS DataBase Reference 65928-58-7(CAS DataBase Reference)
FDA UNII 46M3EV8HHE
NCI Drug Dictionary dienogest
ATC code G03DB08

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H361
Precautionary statements P280
RTECS  RC8899500
HS Code  2937.23.5050
Toxicity LD50 oral in mouse: 4gm/kg
NFPA 704:
0
2 0

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Dienogestrel Spectrum