Chemical Properties of Glutaric acid, hexyl 2-phenoxyethyl ester

InChI

InChI=1S/C19H28O5/c1-2-3-4-8-14-23-18(20)12-9-13-19(21)24-16-15-22-17-10-6-5-7-11-17/h5-7,10-11H,2-4,8-9,12-16H2,1H3

InChI Key

WKMPWXGZPSTKBI-UHFFFAOYSA-N

Formula

C19H28O5

SMILES

CCCCCCOC(=O)CCCC(=O)OCCOc1ccccc1

Molecular Weight¹

336.43

• ω : Acentric Factor.
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[399.37; 915.75]	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			2.80300e+01
Coefficient B			1.55712e+00
Coefficient C			-7.40800e-04
Coefficient D			7.14000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	399.37	J/mol×K	273.00	Calculated Property
Cp,gas	489.35	J/mol×K	353.78	Calculated Property
Cp,gas	570.65	J/mol×K	434.56	Calculated Property
Cp,gas	643.50	J/mol×K	515.33	Calculated Property
Cp,gas	708.13	J/mol×K	596.11	Calculated Property
Cp,gas	764.75	J/mol×K	676.89	Calculated Property
Cp,gas	813.60	J/mol×K	757.67	Calculated Property
Cp,gas	854.90	J/mol×K	838.44	Calculated Property
Cp,gas	888.87	J/mol×K	919.22	Calculated Property
Cp,gas	915.75	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008519; 0.0000645]	Pa×s	[437.20; 695.99]	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			-1.40086e+01
Coefficient B			3.03443e+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.			437.20
Temperature range, max.			695.99
η	0.0008519	Pa×s	437.20	Calculated Property
η	0.0005551	Pa×s	465.95	Calculated Property
η	0.0003802	Pa×s	494.71	Calculated Property
η	0.0002714	Pa×s	523.46	Calculated Property
η	0.0002007	Pa×s	552.22	Calculated Property
η	0.0001529	Pa×s	580.97	Calculated Property
η	0.0001195	Pa×s	609.73	Calculated Property
η	0.0000955	Pa×s	638.48	Calculated Property
η	0.0000778	Pa×s	667.24	Calculated Property
η	0.0000645	Pa×s	695.99	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, hexyl 2-phenoxyethyl ester.

Sources

• Cheméo Relay (1.0)
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.