Chemical Properties of 5-Pregnene-3«beta»,20«beta»,21-triol

5-Pregnene-3«beta»,20«beta»,21-triol

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InChI
InChI=1S/C21H34O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h3,14-19,22-24H,4-12H2,1-2H3/t14-,15?,16?,17?,18+,19+,20-,21-/m1/s1
InChI Key
DAXILKUPMDAOAK-LVWWWKEUSA-N
Formula
C21H34O3
SMILES
CC12CCC(O)CC1=CCC1C2CCC2(C)C(C(O)CO)CCC12
Molecular Weight1
334.49
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Physical Properties

Property Value Unit Source
Δf -118.24 kJ/mol Joback Calculated Property
Δfgas -662.57 kJ/mol Joback Calculated Property
Δfus 32.38 kJ/mol Joback Calculated Property
Δvap 110.23 kJ/mol Joback Calculated Property
log10WS -4.61 Crippen Calculated Property
logPoct/wat 3.280 Crippen Calculated Property
McVol 276.620 ml/mol McGowan Calculated Property
Pc 1901.92 kPa Joback Calculated Property
Inp 2950.00 NIST
Tboil 994.90 K Joback Calculated Property
Tc 1218.95 K Joback Calculated Property
Tfus 596.41 K Joback Calculated Property
Vc 1.030 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1083.83; 1268.96] J/mol×K [994.90; 1218.95] Show Hide
Cp,gas 1083.83 J/mol×K 994.90 Joback Calculated Property
Cp,gas 1110.61 J/mol×K 1032.24 Joback Calculated Property
Cp,gas 1138.60 J/mol×K 1069.58 Joback Calculated Property
Cp,gas 1168.12 J/mol×K 1106.93 Joback Calculated Property
Cp,gas 1199.47 J/mol×K 1144.27 Joback Calculated Property
Cp,gas 1232.98 J/mol×K 1181.61 Joback Calculated Property
Cp,gas 1268.96 J/mol×K 1218.95 Joback Calculated Property

Similar Compounds

5-Pregnene-3«beta»,20«alpha»,21-triol. Androst-5-ene-3,17-diol, (3«beta»,17«alpha»)-. 17-epi-Methandriol. Methandriol. 5-Pregnene-3«beta»,20«alpha»,21-triol, methylboronate. 5-Pregnene-3«beta»,20«beta»,21-triol, methylboronate. 17-Ethylenedioxy-androst-5-en-3beta-ol. 5-Pregnene-3«beta»,20«alpha»,21-triol, triacetate. 5-Pregnene-3«beta»,20«beta»,21-triol, triacetate. 5,8-Pregnadiene-3«beta»,20«alpha»-diol. Pregn-5-en-20-one, 3,17-dihydroxy-, (3«beta»)-. Diosgenin. Androst-5-ene-16beta-propionic acid,3beta,17beta-dihydroxy-, delta-lactone. Androst-5-ene-3,17-diol, 3-acetate, (3«beta»,17«beta»)-. Saringosterol.

Find more compounds similar to 5-Pregnene-3«beta»,20«beta»,21-triol.

Sources

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