Chemical Properties of Sebacic acid, tetrahydrofurfuryl propyl ester

InChI

InChI=1S/C18H32O5/c1-2-13-22-17(19)11-7-5-3-4-6-8-12-18(20)23-15-16-10-9-14-21-16/h16H,2-15H2,1H3

InChI Key

NWUGERRMNQBYOE-UHFFFAOYSA-N

Formula

C18H32O5

SMILES

CCCOC(=O)CCCCCCCCC(=O)OCC1CCCO1

Molecular Weight¹

328.45

• 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	[404.14; 967.00]	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			-5.81900e+00
Coefficient B			1.73292e+00
Coefficient C			-8.79700e-04
Coefficient D			1.19600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	404.14	J/mol×K	273.00	Calculated Property
Cp,gas	502.44	J/mol×K	353.78	Calculated Property
Cp,gas	590.92	J/mol×K	434.56	Calculated Property
Cp,gas	669.96	J/mol×K	515.33	Calculated Property
Cp,gas	739.93	J/mol×K	596.11	Calculated Property
Cp,gas	801.21	J/mol×K	676.89	Calculated Property
Cp,gas	854.18	J/mol×K	757.67	Calculated Property
Cp,gas	899.21	J/mol×K	838.44	Calculated Property
Cp,gas	936.69	J/mol×K	919.22	Calculated Property
Cp,gas	967.00	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0018416; 0.0001254]	Pa×s	[414.75; 670.33]	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			-1.33436e+01
Coefficient B			2.92253e+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.			414.75
Temperature range, max.			670.33
η	0.0018416	Pa×s	414.75	Calculated Property
η	0.0011724	Pa×s	443.15	Calculated Property
η	0.0007881	Pa×s	471.55	Calculated Property
η	0.0005542	Pa×s	499.94	Calculated Property
η	0.0004048	Pa×s	528.34	Calculated Property
η	0.0003053	Pa×s	556.74	Calculated Property
η	0.0002366	Pa×s	585.14	Calculated Property
η	0.0001878	Pa×s	613.54	Calculated Property
η	0.0001521	Pa×s	641.93	Calculated Property
η	0.0001254	Pa×s	670.33	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, tetrahydrofurfuryl propyl ester.

Sources

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

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