Chemical Properties of Glutaric acid, heptyl 3-(2-methoxyethyl)heptyl ester

InChI

InChI=1S/C22H42O5/c1-4-6-8-9-10-17-26-21(23)13-11-14-22(24)27-19-16-20(12-7-5-2)15-18-25-3/h20H,4-19H2,1-3H3

InChI Key

VXSXQXQYOLKUKS-UHFFFAOYSA-N

Formula

C22H42O5

SMILES

CCCCCCCOC(=O)CCCC(=O)OCCC(CCCC)CCOC

Molecular Weight¹

386.57

• 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	[519.95; 1189.59]	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			5.75260e+01
Coefficient B			1.92696e+00
Coefficient C			-8.76000e-04
Coefficient D			8.11000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	519.95	J/mol×K	273.00	Calculated Property
Cp,gas	633.19	J/mol×K	353.78	Calculated Property
Cp,gas	736.13	J/mol×K	434.56	Calculated Property
Cp,gas	829.01	J/mol×K	515.33	Calculated Property
Cp,gas	912.10	J/mol×K	596.11	Calculated Property
Cp,gas	985.65	J/mol×K	676.89	Calculated Property
Cp,gas	1049.92	J/mol×K	757.67	Calculated Property
Cp,gas	1105.16	J/mol×K	838.44	Calculated Property
Cp,gas	1151.63	J/mol×K	919.22	Calculated Property
Cp,gas	1189.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009254; 0.0000406]	Pa×s	[429.59; 721.12]	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			-1.47167e+01
Coefficient B			3.32131e+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.			429.59
Temperature range, max.			721.12
η	0.0009254	Pa×s	429.59	Calculated Property
η	0.0005381	Pa×s	461.98	Calculated Property
η	0.0003360	Pa×s	494.37	Calculated Property
η	0.0002223	Pa×s	526.77	Calculated Property
η	0.0001543	Pa×s	559.16	Calculated Property
η	0.0001114	Pa×s	591.55	Calculated Property
η	0.0000833	Pa×s	623.94	Calculated Property
η	0.0000640	Pa×s	656.34	Calculated Property
η	0.0000505	Pa×s	688.73	Calculated Property
η	0.0000406	Pa×s	721.12	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, heptyl 3-(2-methoxyethyl)heptyl ester.

Sources

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

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