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

InChI

InChI=1S/C15H26O4/c1-5-6-13(4)11-19-15(17)8-7-14(16)18-10-9-12(2)3/h9,13H,5-8,10-11H2,1-4H3

InChI Key

OPKRPJNPSDWCGK-UHFFFAOYSA-N

Formula

C15H26O4

SMILES

CCCC(C)COC(=O)CCC(=O)OCC=C(C)C

Molecular Weight¹

270.36

• 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°	-323.19	kJ/mol	Joback Calculated Property
ΔfH°gas	-740.38	kJ/mol	Joback Calculated Property
ΔfusH°	35.55	kJ/mol	Joback Calculated Property
ΔvapH°	66.95	kJ/mol	Joback Calculated Property
log10WS	-3.44		Crippen Calculated Property
logPoct/wat	3.255		Crippen Calculated Property
McVol	232.790	ml/mol	McGowan Calculated Property
Pc	1598.72	kPa	Joback Calculated Property
Inp	[1818.00; 1818.00]
Inp	1818.00		NIST
Inp	1818.00		NIST
Tboil	698.78	K	Joback Calculated Property
Tc	883.94	K	Joback Calculated Property
Tfus	369.09	K	Joback Calculated Property
Vc	0.898	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[654.83; 738.96]	J/mol×K	[698.78; 883.94]
Cp,gas	654.83	J/mol×K	698.78	Joback Calculated Property
Cp,gas	670.84	J/mol×K	729.64	Joback Calculated Property
Cp,gas	686.03	J/mol×K	760.50	Joback Calculated Property
Cp,gas	700.43	J/mol×K	791.36	Joback Calculated Property
Cp,gas	714.04	J/mol×K	822.22	Joback Calculated Property
Cp,gas	726.87	J/mol×K	853.08	Joback Calculated Property
Cp,gas	738.96	J/mol×K	883.94	Joback Calculated Property

Similar Compounds

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

Sources

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

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