Chemical Properties of Succinic acid, dodec-2-en-1-yl 2-ethylphenyl ester

InChI

InChI=1S/C24H36O4/c1-3-5-6-7-8-9-10-11-12-15-20-27-23(25)18-19-24(26)28-22-17-14-13-16-21(22)4-2/h12-17H,3-11,18-20H2,1-2H3/b15-12+

InChI Key

HJMIDYUXXACHCM-NTCAYCPXSA-N

Formula

C24H36O4

SMILES

CCCCCCCCCC=CCOC(=O)CCC(=O)Oc1ccccc1CC

Molecular Weight¹

388.54

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	60.51	kJ/mol	Joback Calculated Property
ΔvapH°	116.92	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	6.175		Crippen Calculated Property
McVol	335.840	ml/mol	McGowan Calculated Property
Inp	[2759.00; 2759.00]
Inp	2759.00		NIST
Inp	2759.00		NIST
Tboil	654.50	K	Relay (1.0) Calculated Property
Tc	865.53	K	Relay (1.0) Calculated Property
Tfus	280.68	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[478.58; 1121.58]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.89800e+00
Coefficient B			2.05584e+00
Coefficient C			-1.14056e-03
Coefficient D			2.08200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	478.58	J/mol×K	273.00	Calculated Property
Cp,gas	591.88	J/mol×K	353.78	Calculated Property
Cp,gas	693.18	J/mol×K	434.56	Calculated Property
Cp,gas	783.14	J/mol×K	515.33	Calculated Property
Cp,gas	862.42	J/mol×K	596.11	Calculated Property
Cp,gas	931.67	J/mol×K	676.89	Calculated Property
Cp,gas	991.55	J/mol×K	757.67	Calculated Property
Cp,gas	1042.73	J/mol×K	838.44	Calculated Property
Cp,gas	1085.85	J/mol×K	919.22	Calculated Property
Cp,gas	1121.58	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005231; 0.0000375]	Pa×s	[478.76; 773.98]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.44656e+01
Coefficient B			3.30812e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			478.76
Temperature range, max.			773.98
η	0.0005231	Pa×s	478.76	Calculated Property
η	0.0003358	Pa×s	511.56	Calculated Property
η	0.0002275	Pa×s	544.36	Calculated Property
η	0.0001610	Pa×s	577.17	Calculated Property
η	0.0001183	Pa×s	609.97	Calculated Property
η	0.0000897	Pa×s	642.77	Calculated Property
η	0.0000699	Pa×s	675.57	Calculated Property
η	0.0000557	Pa×s	708.38	Calculated Property
η	0.0000453	Pa×s	741.18	Calculated Property
η	0.0000375	Pa×s	773.98	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, dodec-2-en-1-yl 2-ethylphenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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