53-36-1

Name Methylprednisolone acetate
CAS 53-36-1
EINECS(EC#) 200-171-3
Molecular Formula C24H32O6
MDL Number MFCD00144786
Molecular Weight 416.51
MOL File 53-36-1.mol
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Chemical Properties

Appearance Off-White Solid
Melting point  192-195°C
alpha  D20 +101° (dioxane)
Boiling point  454.82°C (rough estimate)
density  1.1156 (rough estimate)
refractive index  1.4593 (estimate)
storage temp.  Refrigerator
solubility  Practically insoluble in water, sparingly soluble in acetone and in ethanol (96 per cent).
form  neat
pka 12.41±0.70(Predicted)
color  White to Off-White
Optical Rotation [α]/D 85 to 105°, c =0.5 in chloroform-d
Usage Glucocorticoid
InChIKey PLBHSZGDDKCEHR-OJNHZLOINA-N
SMILES [C@@]12([H])C[C@@H](C3=CC(=O)C=C[C@]3(C)[C@@]1([H])[C@H](C[C@]1(C)[C@@](CC[C@@]21[H])(O)C(=O)COC(=O)C)O)C |&1:0,3,10,12,14,16,18,21,r|
CAS DataBase Reference 53-36-1(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Warning
Hazard statements  H361
Precautionary statements  P280
Hazard Codes  Xn
Risk Statements 
Safety Statements 
WGK Germany  WGK 3
REACH Registrations Active
HS Code  32041200
Storage Class 11 - Combustible Solids
Hazard Classifications Repr. 2
Toxicity
LD50 oral in rat: > 10gm/kg

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