Chemical Properties of Spiro[cyclopropane-1,6'-[17alpha]pregn-4'-ene]-21'-carboxylic acid, 17'beta-hydroxy-3'-oxo-, gamma-lactone (CAS 6987-59-3)

InChI

InChI=1S/C24H32O3/c1-21-7-3-15(25)13-19(21)23(11-12-23)14-16-17(21)4-8-22(2)18(16)5-9-24(22)10-6-20(26)27-24/h13,16-18H,3-12,14H2,1-2H3

InChI Key

VNSGXUPCNIQYMW-UHFFFAOYSA-N

Formula

C24H32O3

SMILES

CC12CCC(=O)C=C1C1(CC1)CC1C2CCC2(C)C1CCC21CCC(=O)O1

Molecular Weight¹

368.51

CAS

6987-59-3

• 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	[1138.65; 1507.64]	J/mol×K	[973.33; 1254.16]
Cp,gas	1138.65	J/mol×K	973.33	Joback Calculated Property
Cp,gas	1184.53	J/mol×K	1020.13	Joback Calculated Property
Cp,gas	1235.31	J/mol×K	1066.94	Joback Calculated Property
Cp,gas	1292.02	J/mol×K	1113.74	Joback Calculated Property
Cp,gas	1355.64	J/mol×K	1160.55	Joback Calculated Property
Cp,gas	1427.18	J/mol×K	1207.35	Joback Calculated Property
Cp,gas	1507.64	J/mol×K	1254.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Spiro[cyclopropane-1,6'-[17alpha]pregn-4'-ene]-21'-carboxylic acid, 17'beta-hydroxy-3'-oxo-, gamma-lactone.

Sources

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

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