Chemical Properties of Androstan-17-one, 3-hydroxy-, (3«beta»,5«beta»)- (CAS 571-31-3)

Androstan-17-one, 3-hydroxy-, (3«beta»,5«beta»)-

InChI
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14?,15?,16?,18?,19?/m0/s1
InChI Key
QGXBDMJGAMFCBF-LISVHTKMSA-N
Formula
C19H30O2
SMILES
CC12CCC3C(CCC4CC(O)CCC43C)C1CCC2=O
Molecular Weight1
290.44
CAS
571-31-3
Other Names
  • 5«beta»-Androstan-17-one, 3«beta»-hydroxy-
  • epi-5«beta»-Androsterone
  • Epietiocholanolone
  • Etiocholan-3«beta»-ol-17-one
  • 3«beta»-Etiocholanolone
  • 3«beta»-Hydroxy-5«beta»-androstane-17-one
  • 3«beta»-Hydroxyetiocholan-17-one
  • 5«beta»-Epiandrosterone
  • Androstan-3«beta»-ol-17-one, (5«beta»)-
  • 3-Hydroxyandrostan-17-one, (3«beta»,5«beta»)-
  • 5-beta-Androstan-17-one, 3beta-hydroxy-
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 21.22 kJ/mol Joback Calculated Property
log10WS -4.34 Relay (1.0) Calculated Property
logPoct/wat 3.959 Crippen Calculated Property
McVol 242.570 ml/mol McGowan Calculated Property
Tfus 455.01 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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 [870.61; 1022.62] J/mol×K [828.90; 1062.98] Show Hide
Cp,gas 870.61 J/mol×K 828.90 Joback Calculated Property
Cp,gas 895.49 J/mol×K 867.91 Joback Calculated Property
Cp,gas 920.14 J/mol×K 906.93 Joback Calculated Property
Cp,gas 944.87 J/mol×K 945.94 Joback Calculated Property
Cp,gas 969.98 J/mol×K 984.95 Joback Calculated Property
Cp,gas 995.80 J/mol×K 1023.97 Joback Calculated Property
Cp,gas 1022.62 J/mol×K 1062.98 Joback Calculated Property

Similar Compounds

Androstan-17-one, 3-hydroxy-, (3«alpha»,5«beta»)-. Epiandrosterone. Androsterone. Androstane-11,17-dione, 3-hydroxy-, (3«alpha»,5«beta»)-. Androstane-11,17-dione, 3-hydroxy-, (3«alpha»,5«alpha»)-. Pregnan-3«alpha»-ol-20-one. 3Beta-hydroxy-5beta-pregnan-20-one. Allopregnan-3«alpha»-ol-20-one. 5«alpha»-Pregnane-3«beta»-ol-20-one. 24-Cholanoic acid, 3-hydroxy-12-oxo-, methyl ester. Methyl 5-«beta»-cholan-3-«alpha»-ol-12-one-24-oate. 3«alpha»-hydroxy-5«beta»-androstane-17-one. 3«alpha»-hydroxy-5«alpha»-androstane-17-one. 3«alpha»,21-dihydroxy-5«beta»-pregnane-11,20-dione. Androstan-17-one, 3,11-dihydroxy-, (3.alpha.,5.beta.,11.beta.)-.

Find more compounds similar to Androstan-17-one, 3-hydroxy-, (3«beta»,5«beta»)-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.