Chemical Properties of 17Alpha-acetoxy-6alpha-methyl-pregn-4-ene-3,20-dione (CAS 560-12-3)

17Alpha-acetoxy-6alpha-methyl-pregn-4-ene-3,20-dione

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InChI
InChI=1S/C24H34O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h13-14,18-20H,6-12H2,1-5H3/t14-,18?,19?,20?,22?,23?,24-/m1/s1
InChI Key
PSGAAPLEWMOORI-JTOXMAKQSA-N
Formula
C24H34O4
SMILES
CC(=O)OC1(C(C)=O)CCC2C3CC(C)C4=CC(=O)CCC4(C)C3CCC21C
Molecular Weight1
386.52
CAS
560-12-3
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Physical Properties

Property Value Unit Source
ω 0.6100 Relay (... Calculated Property
ΔfG° -171.00 kJ/mol Joback Calculated Property
ΔfH°gas -795.81 kJ/mol Relay (... Calculated Property
ΔfusH° 29.00 kJ/mol Joback Calculated Property
ΔvapH° 117.04 kJ/mol Relay (... Calculated Property
IE 8.23 eV Relay (... Calculated Property
log10WS -4.99 Relay (... Calculated Property
logPoct/wat 4.655 Crippen Calculated Property
McVol 311.860 ml/mol McGowan Calculated Property
Pc 1396.46 kPa Joback Calculated Property
Tboil 666.05 K Relay (... Calculated Property
Tc 956.15 K Relay (... Calculated Property
Tfus 431.36 K Relay (... Calculated Property
Vc 1.100 m3/kmol Relay (... Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1176.88; 1424.53] J/mol×K [985.66; 1235.06] Show Hide
Cp,gas 1176.88 J/mol×K 985.66 Joback Calculated Property
Cp,gas 1211.56 J/mol×K 1027.23 Joback Calculated Property
Cp,gas 1248.23 J/mol×K 1068.79 Joback Calculated Property
Cp,gas 1287.38 J/mol×K 1110.36 Joback Calculated Property
Cp,gas 1329.49 J/mol×K 1151.93 Joback Calculated Property
Cp,gas 1375.04 J/mol×K 1193.50 Joback Calculated Property
Cp,gas 1424.53 J/mol×K 1235.06 Joback Calculated Property

Similar Compounds

Medroxyprogesterone acetate. Hydroxyprogesterone Caproate. methyltestosterone acetate. 17«alpha»,21-Dihydroxypregn-4-en-3,20-dione, 17,21-anhydro (oxetanone). Megestrol acetate. Pregn-4-ene-3,20-dione, 16,17-epoxy-, (16«alpha»)-. Methyltestosterone, HFB. Testosterone acetate. 10A,12a-dimethyl-3,4,4a,5,6,9,10,10a,10b,11,12,12a-dodecahydro-2h-naphtho[2,1-f]chromene-2,8(4bh)-dione. Norethindrone Acetate. Spiro[cyclopropane-1,6'-[17alpha]pregn-4'-ene]-21'-carboxylic acid, 17'beta-hydroxy-3'-oxo-, gamma-lactone. Pregn-4-ene-3,20-dione, 11«alpha»-hydroxy-, acetate. Epitestosterone, hexanoate. Testosterone enanthate. Epitestosterone, octanoate.

Find more compounds similar to 17Alpha-acetoxy-6alpha-methyl-pregn-4-ene-3,20-dione.

Sources

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