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

InChI

InChI=1S/C20H34O4/c1-3-5-7-8-9-10-11-12-13-14-18-24-20(22)16-15-19(21)23-17-6-4-2/h4,6,13-14H,3,5,7-12,15-18H2,1-2H3/b6-4-,14-13+

InChI Key

SYOFIVXEURIPRU-IWXPDAORSA-N

Formula

C20H34O4

SMILES

C/C=C/COC(=O)CCC(=O)OC/C=C/CCCCCCCCC

Molecular Weight¹

338.49

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• IE : Ionization energy (eV).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.8890		Relay (1.0) Calculated Property
ΔfG°	-342.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-879.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	56.70	kJ/mol	Joback Calculated Property
ΔvapH°	106.12	kJ/mol	Relay (1.0) Calculated Property
IE	8.81	eV	Relay (1.0) Calculated Property
log10WS	-5.71		Relay (1.0) Calculated Property
logPoct/wat	5.126		Crippen Calculated Property
McVol	298.940	ml/mol	McGowan Calculated Property
Pc	1093.54	kPa	Joback Calculated Property
Inp	[2396.00; 2396.00]
Inp	2396.00		NIST
Inp	2396.00		NIST
Tboil	606.45	K	Relay (1.0) Calculated Property
Tc	788.08	K	Relay (1.0) Calculated Property
Tfus	259.05	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[903.12; 992.62]	J/mol×K	[781.96; 964.84]
Cp,gas	903.12	J/mol×K	781.96	Joback Calculated Property
Cp,gas	920.41	J/mol×K	812.44	Joback Calculated Property
Cp,gas	936.71	J/mol×K	842.92	Joback Calculated Property
Cp,gas	952.04	J/mol×K	873.40	Joback Calculated Property
Cp,gas	966.45	J/mol×K	903.88	Joback Calculated Property
Cp,gas	979.96	J/mol×K	934.36	Joback Calculated Property
Cp,gas	992.62	J/mol×K	964.84	Joback Calculated Property
η	[0.0000316; 0.0013665]	Pa×s	[389.66; 781.96]
η	0.0013665	Pa×s	389.66	Joback Calculated Property
η	0.0004646	Pa×s	455.04	Joback Calculated Property
η	0.0002072	Pa×s	520.43	Joback Calculated Property
η	0.0001106	Pa×s	585.81	Joback Calculated Property
η	0.0000670	Pa×s	651.19	Joback Calculated Property
η	0.0000445	Pa×s	716.58	Joback Calculated Property
η	0.0000316	Pa×s	781.96	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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