Methylprednisolone 6α-Methylprednisolone
Structural formula
| Business number | 01TW |
|---|---|
| Molecular formula | C22H30O5 |
| Molecular weight | 374.47 |
| label |
Methylprednisolone, Ankylosaurus, Methylprednisolone, methylprednisone, Medrol, Medrone, 11β,17α,21-Trihydroxy-6α-methyl-1,4-pregnadiene-3,20-dione, 6α-Methyl-11β,17α,21-trihydroxy-1,4-pregnadiene-3,20-dione |
Numbering system
CAS number:83-43-2
MDL number:MFCD00010591
EINECS number:201-476-4
RTECS number:TU4146000
BRN number:2340300
PubChem number:24896564
Physical property data
1. Character:Colorless crystal.
2. Density (g/mL,25/4℃): Unsure
3. Relative vapor density (g/mL,AIR=1): Unsure
4. Melting point (ºC): 228~237℃
5. Boiling point (ºC,Normal pressure): Unsure
6. Boiling point (ºC,5.2kPa): Unsure
7. Refractive index: Uncertain
8. Flashpoint (ºC): Unsure
9. Specific optical rotation (º):[α]D 20 +83°(in dioxane).
10. Autoignition point or ignition temperature (ºC): Unsure
11. Vapor pressure (kPa,25ºC：20 mg/kg/45W-C
Rat caliber LD50: >4mg/kg;
Mouse abdominal cavity LD50: 2292mg/kg;
2, other multiple dose toxicity:
Dog caliber TDL0: 210 mg/kg/6W-I
Ecological data
None
Molecular structure data
1. Molar refractive index: 100.08
2. Molar volume (m3/mol）：291.4
3. isotonic specific volume (90.2K):804.8
4. Surface Tension (dyne/cm):58.1
5. Polarizability（10-24cm3):39.67
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 3
3. Number of hydrogen bond acceptors: 5
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 9
6. Topological molecule polar surface area 94.8
7. Number of heavy atoms: 27
8. Surface charge: 0
9. Complexity: 754
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 8
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
None
Storage method
This product should be kept sealed and dry.
Synthesis method
None
Purpose
For biochemical research. Suitable for rheumatoid arthritis, collagen diseases, allergic diseases, eye diseases, lymphoid leukemia, soft tissue inflammation and hemolytic anemia, etc.
y: Arial”>Surface tension (dyne/cm): 58.1
5. Polarizability（10-24cm3):39.67
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 3
3. Number of hydrogen bond acceptors: 5
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 9
6. Topological molecule polar surface area 94.8
7. Number of heavy atoms: 27
8. Surface charge: 0
9. Complexity: 754
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 8
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
None
Storage method
This product should be kept sealed and dry.
Synthesis method
None
Purpose
For biochemical research. Suitable for rheumatoid arthritis, collagen diseases, allergic diseases, eye diseases, lymphoid leukemia, soft tissue inflammation and hemolytic anemia, etc.
