Chemical Properties of Glutaric acid, 4-methoxy-2-methylbutyl nonyl ester

InChI

InChI=1S/C20H38O5/c1-4-5-6-7-8-9-10-15-24-19(21)12-11-13-20(22)25-17-18(2)14-16-23-3/h18H,4-17H2,1-3H3

InChI Key

GRWUPNIFKQCAFE-UHFFFAOYSA-N

Formula

C20H38O5

SMILES

CCCCCCCCCOC(=O)CCCC(=O)OCC(C)CCOC

Molecular Weight¹

358.52

• 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).
• 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, Ionization energy 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	[477.52; 1086.40]	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			5.93440e+01
Coefficient B			1.73696e+00
Coefficient C			-7.67200e-04
Coefficient D			5.73000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	477.52	J/mol×K	273.00	Calculated Property
Cp,gas	580.36	J/mol×K	353.78	Calculated Property
Cp,gas	673.97	J/mol×K	434.56	Calculated Property
Cp,gas	758.56	J/mol×K	515.33	Calculated Property
Cp,gas	834.28	J/mol×K	596.11	Calculated Property
Cp,gas	901.33	J/mol×K	676.89	Calculated Property
Cp,gas	959.89	J/mol×K	757.67	Calculated Property
Cp,gas	1010.13	J/mol×K	838.44	Calculated Property
Cp,gas	1052.24	J/mol×K	919.22	Calculated Property
Cp,gas	1086.40	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0012344; 0.0000548]	Pa×s	[407.05; 683.63]	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			-1.43940e+01
Coefficient B			3.13299e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			407.05
Temperature range, max.			683.63
η	0.0012344	Pa×s	407.05	Calculated Property
η	0.0007191	Pa×s	437.78	Calculated Property
η	0.0004497	Pa×s	468.51	Calculated Property
η	0.0002980	Pa×s	499.24	Calculated Property
η	0.0002071	Pa×s	529.97	Calculated Property
η	0.0001498	Pa×s	560.71	Calculated Property
η	0.0001120	Pa×s	591.44	Calculated Property
η	0.0000862	Pa×s	622.17	Calculated Property
η	0.0000680	Pa×s	652.90	Calculated Property
η	0.0000548	Pa×s	683.63	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 4-methoxy-2-methylbutyl nonyl ester.

Sources

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

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