Chemical Properties of Succinic acid, 2-ethylhexyl 3-methylbut-3-en-1-yl ester

InChI

InChI=1S/C17H30O4/c1-5-7-8-15(6-2)13-21-17(19)10-9-16(18)20-12-11-14(3)4/h15H,3,5-13H2,1-2,4H3

InChI Key

LWIYAZRKODNWAA-UHFFFAOYSA-N

Formula

C17H30O4

SMILES

C=C(C)CCOC(=O)CCC(=O)OCC(CC)CCCC

Molecular Weight¹

298.42

• 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°	-298.73	kJ/mol	Joback Calculated Property
ΔfH°gas	-773.45	kJ/mol	Joback Calculated Property
ΔfusH°	39.25	kJ/mol	Joback Calculated Property
ΔvapH°	70.77	kJ/mol	Joback Calculated Property
log10WS	-4.28		Crippen Calculated Property
logPoct/wat	4.036		Crippen Calculated Property
McVol	260.970	ml/mol	McGowan Calculated Property
Pc	1368.70	kPa	Joback Calculated Property
Inp	[1948.00; 1948.00]
Inp	1948.00		NIST
Inp	1948.00		NIST
Tboil	737.06	K	Joback Calculated Property
Tc	918.87	K	Joback Calculated Property
Tfus	394.95	K	Joback Calculated Property
Vc	1.012	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[765.98; 853.67]	J/mol×K	[737.06; 918.87]
Cp,gas	765.98	J/mol×K	737.06	Joback Calculated Property
Cp,gas	782.76	J/mol×K	767.36	Joback Calculated Property
Cp,gas	798.65	J/mol×K	797.66	Joback Calculated Property
Cp,gas	813.68	J/mol×K	827.96	Joback Calculated Property
Cp,gas	827.85	J/mol×K	858.26	Joback Calculated Property
Cp,gas	841.17	J/mol×K	888.56	Joback Calculated Property
Cp,gas	853.67	J/mol×K	918.87	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-ethylhexyl 3-methylbut-3-en-1-yl ester.

Sources

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

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