Chemical Properties of Glutaric acid, 5-methoxy-3-methylpent-2-yl propyl ester

InChI

InChI=1S/C15H28O5/c1-5-10-19-14(16)7-6-8-15(17)20-13(3)12(2)9-11-18-4/h12-13H,5-11H2,1-4H3

InChI Key

PCLKBVXNJYAPBS-UHFFFAOYSA-N

Formula

C15H28O5

SMILES

CCCOC(=O)CCCC(=O)OC(C)C(C)CCOC

Molecular Weight¹

288.38

• 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	[371.14; 828.99]	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			6.22070e+01
Coefficient B			1.26788e+00
Coefficient C			-4.98400e-04
Coefficient D			-2.70000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	371.14	J/mol×K	273.00	Calculated Property
Cp,gas	448.26	J/mol×K	353.78	Calculated Property
Cp,gas	518.83	J/mol×K	434.56	Calculated Property
Cp,gas	582.86	J/mol×K	515.33	Calculated Property
Cp,gas	640.33	J/mol×K	596.11	Calculated Property
Cp,gas	691.23	J/mol×K	676.89	Calculated Property
Cp,gas	735.55	J/mol×K	757.67	Calculated Property
Cp,gas	773.29	J/mol×K	838.44	Calculated Property
Cp,gas	804.44	J/mol×K	919.22	Calculated Property
Cp,gas	828.99	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0033200; 0.0000964]	Pa×s	[335.70; 599.50]	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			-1.37507e+01
Coefficient B			2.70001e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			335.70
Temperature range, max.			599.50
η	0.0033200	Pa×s	335.70	Calculated Property
η	0.0017404	Pa×s	365.01	Calculated Property
η	0.0010043	Pa×s	394.32	Calculated Property
η	0.0006253	Pa×s	423.63	Calculated Property
η	0.0004140	Pa×s	452.95	Calculated Property
η	0.0002882	Pa×s	482.26	Calculated Property
η	0.0002091	Pa×s	511.57	Calculated Property
η	0.0001571	Pa×s	540.88	Calculated Property
η	0.0001215	Pa×s	570.19	Calculated Property
η	0.0000964	Pa×s	599.50	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 5-methoxy-3-methylpent-2-yl propyl ester.

Sources

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

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