216453-74-6

Name (16α)-16,17-[Butylidenebis(oxy)]-21-hydroxypregna-1,4-diene-3,11,20-trione
CAS 216453-74-6
Molecular Formula C25H32O6
MDL Number MFCD30738207
Molecular Weight 428.52
MOL File 216453-74-6.mol

Chemical Properties

Melting point  >97°C (dec.)
Boiling point  601.7±55.0 °C(Predicted)
density  1.27±0.1 g/cm3(Predicted)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  Chloroform (Slightly), Dichloromethane (Slightly), Methanol (Slightly)
form  Solid
pka 12.83±0.10(Predicted)
color  White to Light Yellow
Major Application pharmaceutical (small molecule)
InChIKey NTERSHSWHLAIHV-ADKFLVHOSA-N
SMILES O1[C@@]2([C@H](OC1CCC)C[C@@H]3[C@@]2(CC(=O)[C@H]4[C@H]3CCC5=CC(=O)C=C[C@@]54C)C)C(=O)CO

Safety Data

WGK Germany  WGK 3
HS Code  2937290000
Storage Class 11 - Combustible Solids

Hazard Information

Supplier