Chemical Properties of Diethylmalonic acid, 2-ethoxylethyl octyl ester

InChI

InChI=1S/C19H36O5/c1-5-9-10-11-12-13-14-23-17(20)19(6-2,7-3)18(21)24-16-15-22-8-4/h5-16H2,1-4H3

InChI Key

KAWHNQXDZCSHST-UHFFFAOYSA-N

Formula

C19H36O5

SMILES

CCCCCCCCOC(=O)C(CC)(CC)C(=O)OCCOCC

Molecular Weight¹

344.49

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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	[455.16; 1035.74]	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			3.74620e+01
Coefficient B			1.76188e+00
Coefficient C			-8.81400e-04
Coefficient D			1.17800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	455.16	J/mol×K	273.00	Calculated Property
Cp,gas	555.68	J/mol×K	353.78	Calculated Property
Cp,gas	646.32	J/mol×K	434.56	Calculated Property
Cp,gas	727.47	J/mol×K	515.33	Calculated Property
Cp,gas	799.49	J/mol×K	596.11	Calculated Property
Cp,gas	862.75	J/mol×K	676.89	Calculated Property
Cp,gas	917.64	J/mol×K	757.67	Calculated Property
Cp,gas	964.52	J/mol×K	838.44	Calculated Property
Cp,gas	1003.76	J/mol×K	919.22	Calculated Property
Cp,gas	1035.74	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0011250; 0.0000577]	Pa×s	[413.20; 665.00]	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			-1.46349e+01
Coefficient B			3.24155e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			413.20
Temperature range, max.			665.00
η	0.0011250	Pa×s	413.20	Calculated Property
η	0.0006841	Pa×s	441.18	Calculated Property
η	0.0004414	Pa×s	469.16	Calculated Property
η	0.0002992	Pa×s	497.13	Calculated Property
η	0.0002114	Pa×s	525.11	Calculated Property
η	0.0001547	Pa×s	553.09	Calculated Property
η	0.0001167	Pa×s	581.07	Calculated Property
η	0.0000903	Pa×s	609.05	Calculated Property
η	0.0000715	Pa×s	637.02	Calculated Property
η	0.0000577	Pa×s	665.00	Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, 2-ethoxylethyl octyl ester.

Sources

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

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