Chemical Properties of 5,8-Pregnadiene-3«beta»,20«alpha»-diol

5,8-Pregnadiene-3«beta»,20«alpha»-diol

InChI
InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15,17-18,22-23H,5-12H2,1-3H3/t13-,15-,17?,18?,20?,21?/m1/s1
InChI Key
NESPUYJOJJTBCC-QGVZDEAMSA-N
Formula
C21H32O2
SMILES
CC(O)C1CCC2C3=C(CCC21C)C1(C)CCC(O)CC1=CC3
Molecular Weight1
316.48
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Physical Properties

Property Value Unit Source
Δfus 26.59 kJ/mol Joback Calculated Property
logPoct/wat 4.371 Crippen Calculated Property
McVol 266.450 ml/mol McGowan Calculated Property

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [965.95; 1126.35] J/mol×K [921.18; 1141.62] Show Hide
Cp,gas 965.95 J/mol×K 921.18 Joback Calculated Property
Cp,gas 989.80 J/mol×K 957.92 Joback Calculated Property
Cp,gas 1014.40 J/mol×K 994.66 Joback Calculated Property
Cp,gas 1040.06 J/mol×K 1031.40 Joback Calculated Property
Cp,gas 1067.07 J/mol×K 1068.14 Joback Calculated Property
Cp,gas 1095.73 J/mol×K 1104.88 Joback Calculated Property
Cp,gas 1126.35 J/mol×K 1141.62 Joback Calculated Property

Similar Compounds

Ergosta-5,8,22-trien-3-ol, (3.beta.,22E)-. 5,7-Pregnadiene-3.beta.,20.alpha.-diol. Androst-5-ene-3,17-diol, (3.beta.,17.alpha.)-. 17-epi-Methandriol. Methandriol. (-)-(1R,2S,6R,10S)-2.alpha.-Hydroxyamorpha-4,7(11)-diene. 24-Ethylcholesta-5,22,25-trien-3-«beta»-ol. Saringosterol. (-)-(1S,6S,9R,10R)-9.alpha.-Hydroxyamorpha-4,7(11)-diene. 5-Pregnene-3«beta»,20«alpha»,21-triol. 5-Pregnene-3«beta»,20«beta»,21-triol. Androst-5,9(11)-diene-3-«beta»,17-«beta»-diol, TMS. Dehydroergosterol. Boldenone. Selina-3,11-dien-6«alpha»-ol.

Find more compounds similar to 5,8-Pregnadiene-3«beta»,20«alpha»-diol.

Sources

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