Chemical Properties of Glutaric acid, 4-acetylphenyl nonyl ester

InChI

InChI=1S/C22H32O5/c1-3-4-5-6-7-8-9-17-26-21(24)11-10-12-22(25)27-20-15-13-19(14-16-20)18(2)23/h13-16H,3-12,17H2,1-2H3

InChI Key

QFICFDPOPVBNPH-UHFFFAOYSA-N

Formula

C22H32O5

SMILES

CCCCCCCCCOC(=O)CCCC(=O)Oc1ccc(C(C)=O)cc1

Molecular Weight¹

376.49

• 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).
• 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, 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	[451.08; 1038.00]	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			2.14610e+01
Coefficient B			1.81784e+00
Coefficient C			-9.29260e-04
Coefficient D			1.27960e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	451.08	J/mol×K	273.00	Calculated Property
Cp,gas	553.93	J/mol×K	353.78	Calculated Property
Cp,gas	646.43	J/mol×K	434.56	Calculated Property
Cp,gas	728.98	J/mol×K	515.33	Calculated Property
Cp,gas	801.99	J/mol×K	596.11	Calculated Property
Cp,gas	865.85	J/mol×K	676.89	Calculated Property
Cp,gas	920.98	J/mol×K	757.67	Calculated Property
Cp,gas	967.78	J/mol×K	838.44	Calculated Property
Cp,gas	1006.65	J/mol×K	919.22	Calculated Property
Cp,gas	1038.00	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005349; 0.0000551]	Pa×s	[511.23; 777.98]	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			-1.41641e+01
Coefficient B			3.38975e+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.			511.23
Temperature range, max.			777.98
η	0.0005349	Pa×s	511.23	Calculated Property
η	0.0003719	Pa×s	540.87	Calculated Property
η	0.0002686	Pa×s	570.51	Calculated Property
η	0.0002003	Pa×s	600.15	Calculated Property
η	0.0001535	Pa×s	629.79	Calculated Property
η	0.0001205	Pa×s	659.42	Calculated Property
η	0.0000966	Pa×s	689.06	Calculated Property
η	0.0000789	Pa×s	718.70	Calculated Property
η	0.0000654	Pa×s	748.34	Calculated Property
η	0.0000551	Pa×s	777.98	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 4-acetylphenyl nonyl ester.

Sources

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

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