Chemical Properties of 3-chloro-24-ethyl-«delta»5,22-Cholestadiene

InChI

InChI=1S/C29H47Cl/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27H,7,11-18H2,1-6H3/b9-8+

InChI Key

CWRKLTLDSODKIL-CMDGGOBGSA-N

Formula

C29H47Cl

SMILES

CCC(C=CC(C)C1CCC2C3CC=C4CC(Cl)CCC4(C)C3CCC12C)C(C)C

Molecular Weight¹

431.14

• 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°	422.99	kJ/mol	Joback Calculated Property
ΔfH°gas	-280.08	kJ/mol	Joback Calculated Property
ΔfusH°	38.19	kJ/mol	Joback Calculated Property
ΔvapH°	81.56	kJ/mol	Joback Calculated Property
log10WS	-9.34		Crippen Calculated Property
logPoct/wat	9.047		Crippen Calculated Property
McVol	379.670	ml/mol	McGowan Calculated Property
Pc	914.94	kPa	Joback Calculated Property
Inp	[3200.00; 3200.00]
Inp	3200.00		NIST
Inp	3200.00		NIST
Tboil	942.11	K	Joback Calculated Property
Tc	1174.67	K	Joback Calculated Property
Tfus	498.95	K	Joback Calculated Property
Vc	1.438	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1373.84; 1586.32]	J/mol×K	[942.11; 1174.67]
Cp,gas	1373.84	J/mol×K	942.11	Joback Calculated Property
Cp,gas	1406.58	J/mol×K	980.87	Joback Calculated Property
Cp,gas	1439.86	J/mol×K	1019.63	Joback Calculated Property
Cp,gas	1474.08	J/mol×K	1058.39	Joback Calculated Property
Cp,gas	1509.64	J/mol×K	1097.15	Joback Calculated Property
Cp,gas	1546.92	J/mol×K	1135.91	Joback Calculated Property
Cp,gas	1586.32	J/mol×K	1174.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-chloro-24-ethyl-«delta»5,22-Cholestadiene.

Sources

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

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