Chemical Properties of Testosterone, 3,17«beta»-bisAc

InChI

InChI=1S/C23H32O4/c1-14(24)26-17-9-11-22(3)16(13-17)5-6-18-19-7-8-21(27-15(2)25)23(19,4)12-10-20(18)22/h9,13,18-21H,5-8,10-12H2,1-4H3/t18?,19?,20?,21-,22-,23-/m1/s1

InChI Key

BHBZEDXYAXMCOT-IYEFYMBESA-N

Formula

C23H32O4

SMILES

CC(=O)OC1=CCC2(C)C(=C1)CCC1C2CCC2(C)C(OC(C)=O)CCC12

Molecular Weight¹

372.50

• 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

Property	Value	Unit	Source
ΔfG°	-128.30	kJ/mol	Joback Calculated Property
ΔfH°gas	-664.83	kJ/mol	Joback Calculated Property
ΔfusH°	34.15	kJ/mol	Joback Calculated Property
ΔvapH°	84.60	kJ/mol	Joback Calculated Property
log10WS	-5.86		Crippen Calculated Property
logPoct/wat	4.938		Crippen Calculated Property
McVol	297.770	ml/mol	McGowan Calculated Property
Pc	1453.46	kPa	Joback Calculated Property
Inp	[2726.00; 2726.00]
Inp	2726.00		NIST
Inp	2726.00		NIST
Tboil	925.95	K	Joback Calculated Property
Tc	1163.28	K	Joback Calculated Property
Tfus	613.33	K	Joback Calculated Property
Vc	1.125	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1058.60; 1229.22]	J/mol×K	[925.95; 1163.28]
Cp,gas	1058.60	J/mol×K	925.95	Joback Calculated Property
Cp,gas	1084.86	J/mol×K	965.50	Joback Calculated Property
Cp,gas	1111.55	J/mol×K	1005.06	Joback Calculated Property
Cp,gas	1139.00	J/mol×K	1044.61	Joback Calculated Property
Cp,gas	1167.55	J/mol×K	1084.17	Joback Calculated Property
Cp,gas	1197.51	J/mol×K	1123.72	Joback Calculated Property
Cp,gas	1229.22	J/mol×K	1163.28	Joback Calculated Property

Similar Compounds

Find more compounds similar to Testosterone, 3,17«beta»-bisAc.

Sources

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

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