Chemical Properties of Prednisolone (CAS 50-24-8)

Prednisolone

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InChI
InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m1/s1
InChI Key
OIGNJSKKLXVSLS-NDNUHCHRSA-N
Formula
C21H28O5
SMILES
CC12CC(O)C3C(CCC4=CC(=O)C=CC43C)C1CCC2(O)C(=O)CO
Molecular Weight1
360.44
CAS
50-24-8
Other Names
  • 1,2-Dehydrohydrocortisone
  • 1,4-Pregnadien-11-«beta»,17-«alpha»,21-triol-3,20-dione
  • 1,4-Pregnadiene-11-«beta»,17-«alpha»,21-triol-3,20-dione
  • 1,4-Pregnadiene-3,20-dione-11-«beta»,17-«alpha»,21-triol
  • 1-Dehydrohydrocortisone
  • 11,17,21-Trihydroxypregna-1,4-diene-3,20-dione, (11«beta»)-
  • 11-«beta»,17,21-Trihydroxypregna-1,4-diene-3,20-dione
  • 11-«beta»,17-«alpha»,21-Trihydroxy-1,4-pregnadiene-3,20-dione
  • 11-«beta»,17-«alpha»,21-Trihydroxypregna-1,4-diene-3,20-dione
  • Co-Hydeltra
  • Codelcortone
  • Cordrol
  • Cortalone
  • Cotogesic
  • Decaprednil
  • Decortin H
  • Delcortol
  • Delta F
  • Delta-Cortef
  • Delta-Ef-Cortelan
  • Delta-Stab
  • Deltacortenol
  • Deltacortril
  • Deltahydrocortisone
  • Deltasolone
  • Deltisilone
  • Derpo PD
  • Dexa-Cortidelt Hostacortin H
  • Di-Adreson F
  • Dicortol
  • Donisolone
  • Dydeltrone
  • Eazolin D
  • Erbacort
  • Erbasona
  • Estilsona
  • Fernisolone
  • Fernisolone P
  • Hostacortin
  • Hostacortin H
  • Hydeltra
  • Hydeltrone
  • Hydrodeltalone
  • Hydrodeltisone
  • Hydroretrocortin
  • Hydroretrocortine
  • K 1557
  • Klismacort
  • Lentosone
  • Metacortandralone
  • Meti-Derm
  • Meticortelone
  • PRDL
  • Panafcortelone
  • Paracortol
  • Paracotol
  • Precortancyl
  • Precortilon
  • Precortisyl
  • Predne-Dome
  • Prednelan
  • Prednicen
  • Predniliderm
  • Prednis
  • Predonin
  • Predonine
  • Preflam
  • Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-, (11«beta»)-
  • Pregna-1,4-diene-3,20-dione, 11«beta»,17,21-trihydroxy-
  • Prelone
  • Prenolone
  • Rolisone
  • Scherisolon
  • Solone
  • Steran
  • Sterane
  • Sterolone
  • Ulacort
  • Ultracorten H
  • Ultracortene-H
  • Ultracortene-hydrogen
  • «DELTA»1-Cortisol
  • «DELTA»1-Dehydrocortisol
  • «DELTA»1-Dehydrohydrocortisone
  • «DELTA»1-Hydrocortisone
Sources

Physical Properties

Property Value Unit Source
Δf -342.84 kJ/mol Joback Calculated Property
Δfgas -834.55 kJ/mol Joback Calculated Property
Δfus 31.93 kJ/mol Joback Calculated Property
Δvap 120.75 kJ/mol Joback Calculated Property
logPoct/wat 1.56 Crippen Calculated Property
Pc 2220.80 kPa Joback Calculated Property
Tboil 1116.43 K Joback Calculated Property
Tc 1366.85 K Joback Calculated Property
Tfus 754.22 K Joback Calculated Property
Vc 1.03 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1151.62 J/mol×K 1116.43 Joback Calculated Property
ΔfusH 38.86 kJ/mol 513.0 NIST

Molecular Descriptors

Joback and Reid Groups
-CH3 2
=CH- (ring) 3
-OH (alcohol) 3
=C< (ring) 1
-CH2- 1
>C< (ring) 3
>C=O (nonring) 1
>CH- (ring) 4
-CH2- (ring) 5
>C=O (ring) 1

Similar Compounds

Methylprednisolone. 17Alpha,21-dihydroxypregna-1,4-diene-3,20-dione. 1,4-Pregnadiene-3,20-dione, 11beta,17alpha,21-trihydroxy-, acetate. Hydrocortisone. 11Beta,17alpha,21-trihydroxy-4-pregnene-3,20-dione. 2Alpha,11beta,17alpha,21-tetrahydroxypregn-4-ene-3,20-dione. Prednisone. 6Alpha,11beta,17alpha,21-tetrahydroxypregn-4-ene-3,20-doine. Hydrocortisone Acetate. Pregn-4-ene-3,20-dione,11beta,17alpha,21-trihydroxy-,21 acetate. 17Alpha,21dihydroxy progesterone. Beclomethasone. Dexamethasone. Betamethasone. Hydrocortamate.

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