Chemical Properties of 5-Androstene-3beta,17beta-diol,16beta-ylacetic acid, lactone

5-Androstene-3beta,17beta-diol,16beta-ylacetic acid, lactone

InChI
InChI=1S/C21H30O3/c1-20-7-5-14(22)11-13(20)3-4-15-16(20)6-8-21(2)17(15)9-12-10-18(23)24-19(12)21/h3,12,14-17,19,22H,4-11H2,1-2H3
InChI Key
UHRRKAOLVBHHLU-UHFFFAOYSA-N
Formula
C21H30O3
SMILES
CC12CCC(O)CC1=CCC1C2CCC2(C)C1CC1CC(=O)OC12
Molecular Weight1
330.47
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Physical Properties

Property Value Unit Source
ΔfusH° 33.35 kJ/mol Joback Calculated Property
ΔvapH° 138.40 kJ/mol Relay (1.0) Calculated Property
log10WS -4.31 Relay (1.0) Calculated Property
logPoct/wat 3.852 Crippen Calculated Property
McVol 261.460 ml/mol McGowan Calculated Property
Tboil 686.17 K Relay (1.0) Calculated Property
Tfus 454.88 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [989.17; 1163.99] J/mol×K [912.49; 1152.32] Show Hide
Cp,gas 989.17 J/mol×K 912.49 Joback Calculated Property
Cp,gas 1015.67 J/mol×K 952.46 Joback Calculated Property
Cp,gas 1042.72 J/mol×K 992.43 Joback Calculated Property
Cp,gas 1070.72 J/mol×K 1032.40 Joback Calculated Property
Cp,gas 1100.01 J/mol×K 1072.37 Joback Calculated Property
Cp,gas 1130.98 J/mol×K 1112.35 Joback Calculated Property
Cp,gas 1163.99 J/mol×K 1152.32 Joback Calculated Property

Similar Compounds

Androst-5-ene-16beta-propionic acid,3beta,17beta-dihydroxy-, delta-lactone. Androst-5-ene-16beta-propionic acid,3beta,17beta-dihydroxy-, delta-lactone, acetate. Androst-5-ene-3,17-diol, 3-acetate, (3«beta»,17«beta»)-. 17-Ethylenedioxy-androst-5-en-3beta-ol. Androst-5-en-16-one, 3,17-bis[(trifluoroacetyl)oxy]-, (3«beta»,17«beta»)-. Secoandrost-5-ene-16-peroxyacetic acid, 16,17-,17-carboxy-3-beta-hydroxy-, oo-tert-butyl o-methyl ester. 16Beta-carboxy-17alpha-pregn-5-en-3beta-ol-20-one-3-acetate. 5-Androsten-3-«beta»,17-«alpha»-diol, TFA. 5-Androsten-3-«beta»,17-«beta»-diol, TFA. 5-Androsten-3-«alpha»,17-«beta»-diol, TFA. Diosgenin. 5-Androsten-3-«beta»,17-«alpha»-diol, HFB. 5-Androsten-3-«alpha»,17-«beta»-diol, HFB. 5-Androsten-3-«beta»,17-«beta»-diol, HFB. Cholesteryl laurate.

Find more compounds similar to 5-Androstene-3beta,17beta-diol,16beta-ylacetic acid, lactone.

Sources

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