Chemical Properties of Glutaric acid, heptyl hexadecyl ester

InChI

InChI=1S/C28H54O4/c1-3-5-7-9-10-11-12-13-14-15-16-17-19-21-26-32-28(30)24-22-23-27(29)31-25-20-18-8-6-4-2/h3-26H2,1-2H3

InChI Key

WVKAVHIZBFOYFO-UHFFFAOYSA-N

Formula

C28H54O4

SMILES

CCCCCCCCCCCCCCCCOC(=O)CCCC(=O)OCCCCCCC

Molecular Weight¹

454.73

• 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	[632.14; 1480.09]	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			2.82540e+01
Coefficient B			2.55424e+00
Coefficient C			-1.31020e-03
Coefficient D			2.07800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	632.14	J/mol×K	273.00	Calculated Property
Cp,gas	777.11	J/mol×K	353.78	Calculated Property
Cp,gas	907.85	J/mol×K	434.56	Calculated Property
Cp,gas	1025.03	J/mol×K	515.33	Calculated Property
Cp,gas	1129.30	J/mol×K	596.11	Calculated Property
Cp,gas	1221.33	J/mol×K	676.89	Calculated Property
Cp,gas	1301.77	J/mol×K	757.67	Calculated Property
Cp,gas	1371.27	J/mol×K	838.44	Calculated Property
Cp,gas	1430.49	J/mol×K	919.22	Calculated Property
Cp,gas	1480.09	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0004890; 0.0000218]	Pa×s	[489.98; 829.13]	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			-1.52283e+01
Coefficient B			3.72636e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			489.98
Temperature range, max.			829.13
η	0.0004890	Pa×s	489.98	Calculated Property
η	0.0002841	Pa×s	527.66	Calculated Property
η	0.0001774	Pa×s	565.35	Calculated Property
η	0.0001175	Pa×s	603.03	Calculated Property
η	0.0000817	Pa×s	640.71	Calculated Property
η	0.0000592	Pa×s	678.40	Calculated Property
η	0.0000443	Pa×s	716.08	Calculated Property
η	0.0000342	Pa×s	753.76	Calculated Property
η	0.0000270	Pa×s	791.45	Calculated Property
η	0.0000218	Pa×s	829.13	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, heptyl hexadecyl ester.

Sources

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

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