Chemical Properties of Androstan-17-one, 3,11-dihydroxy-, (3.alpha.,5.beta.,11.beta.)-

InChI

InChI=1S/C19H30O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12-,13?,14?,15+,17?,18?,19?/m1/s1

InChI Key

PIXFHVWJOVNKQK-BEWPHQSDSA-N

Formula

C19H30O3

SMILES

CC12C[C@H](O)C3C(CC[C@@H]4C[C@H](O)CCC34C)C1CCC2=O

Molecular Weight¹

306.45

Other Names

• 11-Hydroxyetiocholanolone
• 3«alpha»,11«beta»-Dihydroxy-5«beta»-androstan-17-one
• 5«beta»-Androstan-3«alpha»,11«beta»-diol-17-one
• hydroxyisoandrosterone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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	[951.07; 1105.34]	J/mol×K	[916.41; 1140.77]
Cp,gas	951.07	J/mol×K	916.41	Joback Calculated Property
Cp,gas	975.05	J/mol×K	953.80	Joback Calculated Property
Cp,gas	999.37	J/mol×K	991.20	Joback Calculated Property
Cp,gas	1024.29	J/mol×K	1028.59	Joback Calculated Property
Cp,gas	1050.08	J/mol×K	1065.98	Joback Calculated Property
Cp,gas	1077.00	J/mol×K	1103.38	Joback Calculated Property
Cp,gas	1105.34	J/mol×K	1140.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Androstan-17-one, 3,11-dihydroxy-, (3.alpha.,5.beta.,11.beta.)-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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