Chemical Properties of 5-Pregnen-3-«beta»,20-«beta»-diol, HFB

5-Pregnen-3-«beta»,20-«beta»-diol, HFB

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InChI
InChI=1S/C29H32F14O4/c1-13(46-20(44)24(30,31)26(34,35)28(38,39)40)17-6-7-18-16-5-4-14-12-15(8-10-22(14,2)19(16)9-11-23(17,18)3)47-21(45)25(32,33)27(36,37)29(41,42)43/h4,13,15-19H,5-12H2,1-3H3/t13-,15-,16?,17+,18?,19?,22-,23+/m1/s1
InChI Key
XNCNNHDGAQVERN-JHLVREFVSA-N
Formula
C29H32F14O4
SMILES
CC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C1CCC2C3CC=C4CC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)CCC4(C)C3CCC12C
Molecular Weight1
710.54
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Physical Properties

Property Value Unit Source
Δf -2818.56 kJ/mol Joback Calculated Property
Δfgas -3658.64 kJ/mol Joback Calculated Property
Δfus 45.04 kJ/mol Joback Calculated Property
Δvap 77.09 kJ/mol Joback Calculated Property
log10WS -10.47 Crippen Calculated Property
logPoct/wat 9.075 Crippen Calculated Property
McVol 411.390 ml/mol McGowan Calculated Property
Pc 706.96 kPa Joback Calculated Property
Inp [2593.00; 2599.00]   Show Hide
Inp 2593.00 NIST
Inp 2599.00 NIST
Tboil 1024.38 K Joback Calculated Property
Tc 1258.51 K Joback Calculated Property
Tfus 671.21 K Joback Calculated Property
Vc 1.655 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1585.64; 1810.07] J/mol×K [1024.38; 1258.51] Show Hide
Cp,gas 1585.64 J/mol×K 1024.38 Joback Calculated Property
Cp,gas 1616.66 J/mol×K 1063.40 Joback Calculated Property
Cp,gas 1649.54 J/mol×K 1102.42 Joback Calculated Property
Cp,gas 1684.80 J/mol×K 1141.44 Joback Calculated Property
Cp,gas 1722.97 J/mol×K 1180.46 Joback Calculated Property
Cp,gas 1764.55 J/mol×K 1219.48 Joback Calculated Property
Cp,gas 1810.07 J/mol×K 1258.51 Joback Calculated Property

Similar Compounds

5-Pregnen-3-«beta»,20-«alpha»-diol, HFB. 5-Androsten-3-«beta»,17-«alpha»-diol, HFB. 5-Androsten-3-«alpha»,17-«beta»-diol, HFB. 5-Androsten-3-«beta»,17-«beta»-diol, HFB. 5-Pregnen-3-«beta»,20-«beta»-diol, TFA. 5-Pregnen-3-«beta»,20-«alpha»-diol, TFA. Androst-5,9(11)-diene-3-«beta»,17-«beta»-diol, HFB. 5-«alpha»-Androst-9(11)-ene-3-«alpha»,17-«beta»-diol, HFB. trans-Dehydroandrosterone, heptafluorobutyrate. 5-Androsten-3-«beta»,17-«alpha»-diol, TFA. 5-Androsten-3-«beta»,17-«beta»-diol, TFA. 5-Androsten-3-«alpha»,17-«beta»-diol, TFA. Testosterone, HFB. Cholesterol, pentafluoropropionate. 5-Pregnene-3«beta»,20«alpha»,21-triol, triacetate.

Find more compounds similar to 5-Pregnen-3-«beta»,20-«beta»-diol, HFB.

Sources

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