Chemical Properties of 17-Ethylenedioxy-androst-5-en-3beta-ol (CAS 7745-40-6)

InChI

InChI=1S/C21H32O3/c1-19-8-5-15(22)13-14(19)3-4-16-17(19)6-9-20(2)18(16)7-10-21(20)23-11-12-24-21/h3,15-18,22H,4-13H2,1-2H3

InChI Key

SXXRMGBMPQWUTB-UHFFFAOYSA-N

Formula

C21H32O3

SMILES

CC12CCC(O)CC1=CCC1C2CCC2(C)C1CCC21OCCO1

Molecular Weight¹

332.48

CAS

7745-40-6

• 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).
• 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	[980.80; 1184.04]	J/mol×K	[880.80; 1121.21]
Cp,gas	980.80	J/mol×K	880.80	Joback Calculated Property
Cp,gas	1009.55	J/mol×K	920.87	Joback Calculated Property
Cp,gas	1039.64	J/mol×K	960.94	Joback Calculated Property
Cp,gas	1071.61	J/mol×K	1001.00	Joback Calculated Property
Cp,gas	1105.98	J/mol×K	1041.07	Joback Calculated Property
Cp,gas	1143.28	J/mol×K	1081.14	Joback Calculated Property
Cp,gas	1184.04	J/mol×K	1121.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to 17-Ethylenedioxy-androst-5-en-3beta-ol.

Sources

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

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