Chemical Properties of trans-Dehydroandrosterone, pentafluoropropionate

InChI

InChI=1S/C22H27F5O3/c1-19-9-7-13(30-18(29)21(23,24)22(25,26)27)11-12(19)3-4-14-15-5-6-17(28)20(15,2)10-8-16(14)19/h3,13-16H,4-11H2,1-2H3

InChI Key

WQVZUVYAIXHPIW-UHFFFAOYSA-N

Formula

C22H27F5O3

SMILES

CC12CCC3C(CC=C4CC(OC(=O)C(F)(F)C(F)(F)F)CCC43C)C1CCC2=O

Molecular Weight¹

434.44

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1044.69; 1194.15]	J/mol×K	[880.35; 1105.27]
Cp,gas	1044.69	J/mol×K	880.35	Joback Calculated Property
Cp,gas	1068.26	J/mol×K	917.84	Joback Calculated Property
Cp,gas	1091.94	J/mol×K	955.32	Joback Calculated Property
Cp,gas	1116.05	J/mol×K	992.81	Joback Calculated Property
Cp,gas	1140.91	J/mol×K	1030.30	Joback Calculated Property
Cp,gas	1166.83	J/mol×K	1067.79	Joback Calculated Property
Cp,gas	1194.15	J/mol×K	1105.27	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-Dehydroandrosterone, pentafluoropropionate.

Sources

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

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