- InChI
- InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3
- InChI Key
- VHRSUDSXCMQTMA-UHFFFAOYSA-N
- Formula
- C22H30O5
- SMILES
-
CC1CC2C(C(O)CC3(C)C2CCC3(O)C(=
O)CO)C2(C)C=CC(=O)C=C12 - Molecular Weight1
- 374.47
- CAS
- 83-43-2
- Other Names
-
- (6.alpha.,11.beta.)-11,17,21-trihydroxy-6-methylpregna-1,4-diene-3,20-dione
- (6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one
- (6«alpha»,11«beta»)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione
- (6«alpha»,11«beta»)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione
- 1,4-Pregnadiene-3,20-dione, 11beta,17alpha,21-trihydroxy-6alpha-methyl-
- 11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
- 11-«beta»,17,21-Trihydroxy-6-«alpha»-methylpregna-1,4-diene-3,20-dione
- 11-«beta»,17-«alpha»,21-Trihydroxy-6-«alpha»-methyl-1,4-pregnadiene-3,20-dione
- 11-«beta»,17,21-Trihydroxy-6-«alpha»-methylpregna-1,4-diene-3,20-dione
- 11-«beta»,17-«alpha»,21-Trihydroxy-6-«alpha»-methyl-1,4-pregnadiene-3,20-dione
- 6-«alpha»-Methylprednisolone
- 6-«alpha»-Methylprednisolone
- A-Methapred
- Besonia
- Depo-Medrol
- Dopomedrol
- M-Prednisol
- MEPRDL
- Medesone
- Medrate
- Medrol
- Medrol adt pak
- Medrol dosepak
- Medrone
- Mesopren
- Metastab
- Metilbetasone
- Metrisone
- Moderin
- NSC-19987
- Noretona
- Prednisolone, 6«alpha»-methyl-
- Prednisolone, 6«alpha»-methyl-
- Prednisolone, methyl-
- Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-6-methyl-, (6«alpha»,11«beta»)-
- Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-6-methyl-, (6«alpha»,11«beta»)-
- Pregna-1,4-diene-3,20-dione, 11«beta»,17,21-trihydroxy-6«alpha»-methyl-
- Pregna-1,4-diene-3,20-dione, 11«beta»,17,21-trihydroxy-6«alpha»-methyl-
- Pregna-1,4-diene-3,20-dione, 6«alpha»-methyl-11«beta»-17,21-trihydroxy-
- Pregna-1,4-diene-3,20-dione, 6«alpha»-methyl-11«beta»-17,21-trihydroxy-
- Promacortine
- Suprametil
- U 7532
- Urbason
- Urbasone
- Urbazone
- Wyacort
- «DELTA»1-6«alpha»-Methylhydrocortisone
- «DELTA»1-6«alpha»-Methylhydrocortisone
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -342.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -875.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 122.67 | kJ/mol | Joback Calculated Property |
| log10WS | -3.19 | Aq. Sol... | |
| logPoct/wat | 1.804 | Crippen Calculated Property | |
| McVol | 289.550 | ml/mol | McGowan Calculated Property |
| Pc | 1973.55 | kPa | Joback Calculated Property |
| Tboil | 1134.64 | K | Joback Calculated Property |
| Tc | 1389.79 | K | Joback Calculated Property |
| Tfus | 505.65 | K | Aq. Sol... |
| Vc | 1.087 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1229.87; 1576.74] | J/mol×K | [1134.64; 1389.79] | 
|
| Cp,gas | 1229.87 | J/mol×K | 1134.64 | Joback Calculated Property |
| Cp,gas | 1275.04 | J/mol×K | 1177.17 | Joback Calculated Property |
| Cp,gas | 1324.54 | J/mol×K | 1219.69 | Joback Calculated Property |
| Cp,gas | 1378.93 | J/mol×K | 1262.22 | Joback Calculated Property |
| Cp,gas | 1438.73 | J/mol×K | 1304.74 | Joback Calculated Property |
| Cp,gas | 1504.49 | J/mol×K | 1347.27 | Joback Calculated Property |
| Cp,gas | 1576.74 | J/mol×K | 1389.79 | Joback Calculated Property |
| ΔvapH | 192.20 | kJ/mol | 387.90 | Compreh... |
Similar Compounds
Find more compounds similar to Methylprednisolone.
Sources
- Crippen Method
- Comprehensive thermodynamic study of methylprednisolone
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
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