Chemical Properties of Glutaric acid, 2-methylpent-3-yl 2,3-dimethylphenyl ester

InChI

InChI=1S/C19H28O4/c1-6-16(13(2)3)22-18(20)11-8-12-19(21)23-17-10-7-9-14(4)15(17)5/h7,9-10,13,16H,6,8,11-12H2,1-5H3

InChI Key

SLBWVGLDABUOKB-UHFFFAOYSA-N

Formula

C19H28O4

SMILES

CCC(OC(=O)CCCC(=O)Oc1cccc(C)c1C)C(C)C

Molecular Weight¹

320.43

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[388.43; 892.24]	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			2.77640e+01
Coefficient B			1.51320e+00
Coefficient C			-7.24120e-04
Coefficient D			7.54000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	388.43	J/mol×K	273.00	Calculated Property
Cp,gas	475.81	J/mol×K	353.78	Calculated Property
Cp,gas	554.78	J/mol×K	434.56	Calculated Property
Cp,gas	625.58	J/mol×K	515.33	Calculated Property
Cp,gas	688.46	J/mol×K	596.11	Calculated Property
Cp,gas	743.64	J/mol×K	676.89	Calculated Property
Cp,gas	791.37	J/mol×K	757.67	Calculated Property
Cp,gas	831.89	J/mol×K	838.44	Calculated Property
Cp,gas	865.44	J/mol×K	919.22	Calculated Property
Cp,gas	892.24	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0012140; 0.0000696]	Pa×s	[410.01; 690.59]	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			-1.37513e+01
Coefficient B			2.88546e+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.			410.01
Temperature range, max.			690.59
η	0.0012140	Pa×s	410.01	Calculated Property
η	0.0007383	Pa×s	441.19	Calculated Property
η	0.0004795	Pa×s	472.36	Calculated Property
η	0.0003285	Pa×s	503.54	Calculated Property
η	0.0002352	Pa×s	534.71	Calculated Property
η	0.0001747	Pa×s	565.89	Calculated Property
η	0.0001339	Pa×s	597.07	Calculated Property
η	0.0001053	Pa×s	628.24	Calculated Property
η	0.0000848	Pa×s	659.42	Calculated Property
η	0.0000696	Pa×s	690.59	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-methylpent-3-yl 2,3-dimethylphenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.