Chemical Properties of 2,5-Seco-a,a-dinor-5beta-androstane-2,5,17beta-triol (CAS 3523-67-9)

InChI

InChI=1S/C17H30O3/c1-16-8-7-13-11(12(16)4-6-15(16)20)3-5-14(19)17(13,2)9-10-18/h11-15,18-20H,3-10H2,1-2H3

InChI Key

LWALRQNSMBJKQV-UHFFFAOYSA-N

Formula

C17H30O3

SMILES

CC1(CCO)C(O)CCC2C1CCC1(C)C(O)CCC21

Molecular Weight¹

282.42

CAS

3523-67-9

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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	[869.21; 999.19]	J/mol×K	[884.00; 1087.86]
Cp,gas	869.21	J/mol×K	884.00	Joback Calculated Property
Cp,gas	889.50	J/mol×K	917.98	Joback Calculated Property
Cp,gas	910.07	J/mol×K	951.95	Joback Calculated Property
Cp,gas	931.11	J/mol×K	985.93	Joback Calculated Property
Cp,gas	952.84	J/mol×K	1019.90	Joback Calculated Property
Cp,gas	975.46	J/mol×K	1053.88	Joback Calculated Property
Cp,gas	999.19	J/mol×K	1087.86	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,5-Seco-a,a-dinor-5beta-androstane-2,5,17beta-triol.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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