Chemical Properties of Androst-5,9(11)-diene-3-«beta»,17-«beta»-diol, HFB

Androst-5,9(11)-diene-3-«beta»,17-«beta»-diol, HFB

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InChI
InChI=1S/C27H26F14O4/c1-20-9-7-13(44-18(42)22(28,29)24(32,33)26(36,37)38)11-12(20)3-4-14-15-5-6-17(21(15,2)10-8-16(14)20)45-19(43)23(30,31)25(34,35)27(39,40)41/h3,8,13-15,17H,4-7,9-11H2,1-2H3/t13-,14?,15?,17-,20-,21-/m1/s1
InChI Key
UCBYJFZGAXTFFC-WKCVYIDDSA-N
Formula
C27H26F14O4
SMILES
CC12CCC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1=CCC1C2=CCC2(C)C(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)CCC12
Molecular Weight1
680.47

Physical Properties

Property Value Unit Source
Δf -2804.92 kJ/mol Joback Calculated Property
Δfgas -3545.43 kJ/mol Joback Calculated Property
Δfus 43.15 kJ/mol Joback Calculated Property
Δvap 74.29 kJ/mol Joback Calculated Property
log10WS -9.97 Crippen Calculated Property
logPoct/wat 8.359 Crippen Calculated Property
McVol 378.910 ml/mol McGowan Calculated Property
Pc 805.70 kPa Joback Calculated Property
Inp [2406.00; 2407.00]   Show Hide
Inp 2407.00 NIST
Inp 2406.00 NIST
Inp 2407.00 NIST
Tboil 987.87 K Joback Calculated Property
Tc 1210.22 K Joback Calculated Property
Tfus 681.19 K Joback Calculated Property
Vc 1.536 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1413.87; 1600.88] J/mol×K [987.87; 1210.22] Show Hide
Cp,gas 1413.87 J/mol×K 987.87 Joback Calculated Property
Cp,gas 1439.92 J/mol×K 1024.93 Joback Calculated Property
Cp,gas 1467.43 J/mol×K 1061.99 Joback Calculated Property
Cp,gas 1496.84 J/mol×K 1099.05 Joback Calculated Property
Cp,gas 1528.60 J/mol×K 1136.10 Joback Calculated Property
Cp,gas 1563.13 J/mol×K 1173.16 Joback Calculated Property
Cp,gas 1600.88 J/mol×K 1210.22 Joback Calculated Property

Similar Compounds

5-Androsten-3-«beta»,17-«alpha»-diol, HFB. 5-Androsten-3-«alpha»,17-«beta»-diol, HFB. 5-Androsten-3-«beta»,17-«beta»-diol, HFB. Androst-5,9(11)-diene-3-«beta»,17-«beta»-diol, TFA. 5-Pregnen-3-«beta»,20-«beta»-diol, HFB. 5-Pregnen-3-«beta»,20-«alpha»-diol, HFB. 5-«alpha»-Androst-9(11)-ene-3-«alpha»,17-«beta»-diol, HFB. Testosterone, 3-TFA, 17«beta»-HFB. Testosterone, 3-chlorodifluoroacetate, 17«beta»-HFBate. Testosterone, 3-Ac, 17«beta»-HFB. Testosterone, 3-HFB, 17«beta»-pentadecaflorooctanoate. Testosterone, 3-pentafluoropropionate, 17«beta»-HFB. Testosterone, 3-HFB, 17«beta»-chlorodifluoroacetate. Testosterone, 3-HFB, 17«beta»-pentafluoropropionate. Testosterone, 3-HFB, 17«beta»-TFA.

Find more compounds similar to Androst-5,9(11)-diene-3-«beta»,17-«beta»-diol, HFB.

Sources

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