Chemical Properties of Androsta-1,4-diene-16beta-propionic acid, 17beta-hydroxy-3-oxo-, delta-lactone

InChI

InChI=1S/C22H28O3/c1-21-9-7-15(23)12-14(21)4-5-16-17(21)8-10-22(2)18(16)11-13-3-6-19(24)25-20(13)22/h7,9,12-13,16-18,20H,3-6,8,10-11H2,1-2H3

InChI Key

QLYHBVWSOGXASK-UHFFFAOYSA-N

Formula

C22H28O3

SMILES

CC12C=CC(=O)C=C1CCC1C2CCC2(C)C1CC1CCC(=O)OC12

Molecular Weight¹

340.46

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

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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	[990.75; 1183.41]	J/mol×K	[919.11; 1189.08]
Cp,gas	990.75	J/mol×K	919.11	Joback Calculated Property
Cp,gas	1020.08	J/mol×K	964.11	Joback Calculated Property
Cp,gas	1049.90	J/mol×K	1009.10	Joback Calculated Property
Cp,gas	1080.68	J/mol×K	1054.10	Joback Calculated Property
Cp,gas	1112.87	J/mol×K	1099.09	Joback Calculated Property
Cp,gas	1146.96	J/mol×K	1144.09	Joback Calculated Property
Cp,gas	1183.41	J/mol×K	1189.08	Joback Calculated Property

Similar Compounds

Find more compounds similar to Androsta-1,4-diene-16beta-propionic acid, 17beta-hydroxy-3-oxo-, delta-lactone.

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
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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