16-Dehydroprogesterone
- Product Name16-Dehydroprogesterone
- CAS1096-38-4
- CBNumberCB7470879
- MFC21H28O2
- MW312.45
- EINECS214-142-8
- MDL NumberMFCD00003651
- MOL File1096-38-4.mol
Chemical Properties
Melting point | 185-187 °C(lit.) |
Boiling point | 461.0±45.0 °C(Predicted) |
Density | 1.10±0.1 g/cm3(Predicted) |
storage temp. | 2-8°C |
solubility | Chloroform (Slightly), DMSO (Slightly, Sonicated), Methanol (Slightly) |
form | Solid |
color | Off-White to Pale Yellow |
InChI | InChI=1S/C21H28O2/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/h6,12,16,18-19H,4-5,7-11H2,1-3H3/t16-,18-,19-,20-,21+/m0/s1 |
InChIKey | VRRHHTISESGZFN-RKFFNLMFSA-N |
SMILES | C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)C(C(=O)C)=CC3)CC2 |
CAS DataBase Reference | 1096-38-4(CAS DataBase Reference) |
FDA UNII | JU0YQ9DZ2O |
Safety
Symbol(GHS) | |
Signal word | Warning |
Hazard statements | H302-H312-H332-H351 |
Precautionary statements | P280 |
Hazard Codes | Xn |
Risk Statements | 20/21/22-40 |
Safety Statements | 22-36 |
WGK Germany | 3 |