Chemical Properties of Succinic acid, 8-chlorooctyl 3-methylbut-3-en-1-yl ester

InChI

InChI=1S/C17H29ClO4/c1-15(2)11-14-22-17(20)10-9-16(19)21-13-8-6-4-3-5-7-12-18/h1,3-14H2,2H3

InChI Key

FCOVUAUGPFVYFC-UHFFFAOYSA-N

Formula

C17H29ClO4

SMILES

C=C(C)CCOC(=O)CCC(=O)OCCCCCCCCCl

Molecular Weight¹

332.86

• 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°	-308.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-783.91	kJ/mol	Joback Calculated Property
ΔfusH°	46.97	kJ/mol	Joback Calculated Property
ΔvapH°	75.54	kJ/mol	Joback Calculated Property
log10WS	-4.67		Crippen Calculated Property
logPoct/wat	4.399		Crippen Calculated Property
McVol	273.210	ml/mol	McGowan Calculated Property
Pc	1324.24	kPa	Joback Calculated Property
Inp	[2354.00; 2354.00]
Inp	2354.00		NIST
Inp	2354.00		NIST
Tboil	774.93	K	Joback Calculated Property
Tc	960.14	K	Joback Calculated Property
Tfus	439.87	K	Joback Calculated Property
Vc	1.067	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[796.14; 877.34]	J/mol×K	[774.93; 960.14]
Cp,gas	796.14	J/mol×K	774.93	Joback Calculated Property
Cp,gas	811.84	J/mol×K	805.80	Joback Calculated Property
Cp,gas	826.65	J/mol×K	836.67	Joback Calculated Property
Cp,gas	840.59	J/mol×K	867.53	Joback Calculated Property
Cp,gas	853.67	J/mol×K	898.40	Joback Calculated Property
Cp,gas	865.92	J/mol×K	929.27	Joback Calculated Property
Cp,gas	877.34	J/mol×K	960.14	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 8-chlorooctyl 3-methylbut-3-en-1-yl ester.

Sources

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

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