3044-42-6

Name 11beta,21-dihydroxypregna-1,4,16-triene-3,20-dione 21-acetate
CAS 3044-42-6
EINECS(EC#) 221-250-9
Molecular Formula C23H28O5
MDL Number MFCD18910603
Molecular Weight 384.47
MOL File 3044-42-6.mol
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Chemical Properties

Melting point  208-209 °C
Boiling point  553.4±50.0 °C(Predicted)
density  1.24±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DCM, Ethyl Acetate
form  Solid
pka 14.30±0.70(Predicted)
color  Brown
Major Application pharmaceutical small molecule
InChIKey ABGUZAVIFZZDDZ-ADBLJHFGNA-N
SMILES C1(=O)C=C2[C@](C)(C=C1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](C[C@@H]1O)(C)C(C(=O)COC(=O)C)=CC3)CC2 |&1:4,8,10,12,14,16,r|

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Warning
Hazard statements  H361-H412
Precautionary statements  P273-P501-P201-P202-P281-P308+P313-P405-P501
WGK Germany  WGK 3
REACH Registrations Active
Storage Class 11 - Combustible Solids
Hazard Classifications Repr. 2

Hazard Information

Spectrum Detail

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