Chemical Properties of 5-.alpha.-Androst-9(11)-ene-3-.alpha.,17-.beta.-diol, TFA

5-.alpha.-Androst-9(11)-ene-3-.alpha.,17-.beta.-diol, TFA

InChI
InChI=1S/C23H28F6O4/c1-20-9-7-13(32-18(30)22(24,25)26)11-12(20)3-4-14-15-5-6-17(33-19(31)23(27,28)29)21(15,2)10-8-16(14)20/h8,12-15,17H,3-7,9-11H2,1-2H3/t12-,13+,14?,15?,17-,20-,21-/m0/s1
InChI Key
WRJKDUBPOVWNJS-GCAIQXNSSA-N
Formula
C23H28F6O4
SMILES
C[C@]12CC=C3C(CC[C@H]4C[C@H](OC(=O)C(F)(F)F)CC[C@]34C)C1CC[C@@H]2OC(=O)C(F)(F)F
Molecular Weight1
482.46
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Physical Properties

Property Value Unit Source
ΔfusH° 41.21 kJ/mol Joback Calculated Property
logPoct/wat 5.897 Crippen Calculated Property
McVol 312.690 ml/mol McGowan Calculated Property
Inp [2265.00; 2270.00]   Show Hide
Inp 2265.00 NIST
Inp 2270.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [449.13; 1195.64] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.66260e+02
Coefficient B3.34604e+00
Coefficient C-2.94824e-03
Coefficient D1.06410e-06
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 449.13 J/mol×K 273.00 Calculated Property
Cp,gas 595.61 J/mol×K 353.78 Calculated Property
Cp,gas 718.36 J/mol×K 434.56 Calculated Property
Cp,gas 820.74 J/mol×K 515.33 Calculated Property
Cp,gas 906.10 J/mol×K 596.11 Calculated Property
Cp,gas 977.83 J/mol×K 676.89 Calculated Property
Cp,gas 1039.29 J/mol×K 757.67 Calculated Property
Cp,gas 1093.83 J/mol×K 838.44 Calculated Property
Cp,gas 1144.82 J/mol×K 919.22 Calculated Property
Cp,gas 1195.64 J/mol×K 1000.00 Calculated Property

Similar Compounds

5-Androsten-3-«alpha»,17-«beta»-diol, TFA. 5-Androsten-3-«beta»,17-«beta»-diol, TFA. 5-Androsten-3-«beta»,17-«alpha»-diol, TFA. 5-«alpha»-Androst-9(11)-ene-3-«alpha»,17-«beta»-diol, HFB. 24,24-Dimethyl-9(11)-lanostenol acetate. 24-Methyl-24-dihydroparkeol acetate. Lanost-9(11)-en-3-ol, acetate, (3«beta»,8«alpha»,13«alpha»,14«beta»,17«alpha»)-. Epifernenol (9[11]-fernen-3A-ol) acetate. 24,25-Dimethyl-9(11)-lanostenol acetate. 24-Dihydroparkeol acetate. Trematol (21-epi-9[11]-fernenol) acetate. Fernenol (9[11]-fernenol) acetate. 31-Nor-9(11)-lanostenol acetate. 24-Methyl-31-nor-9(11)-lanostenol acetate. 7-Tirucallenol acetate.

Find more compounds similar to 5-.alpha.-Androst-9(11)-ene-3-.alpha.,17-.beta.-diol, TFA.

Sources

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