Chemical Properties of Sebacic acid, tetrahydrofurfuryl undecyl ester

InChI

InChI=1S/C26H48O5/c1-2-3-4-5-6-7-10-13-16-21-30-25(27)19-14-11-8-9-12-15-20-26(28)31-23-24-18-17-22-29-24/h24H,2-23H2,1H3

InChI Key

HMSATPKJJQSGJN-UHFFFAOYSA-N

Formula

C26H48O5

SMILES

CCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCC1CCCO1

Molecular Weight¹

440.66

• 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	[573.85; 1379.73]	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			-1.30910e+01
Coefficient B			2.49292e+00
Coefficient C			-1.31490e-03
Coefficient D			2.14800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	573.85	J/mol×K	273.00	Calculated Property
Cp,gas	713.79	J/mol×K	353.78	Calculated Property
Cp,gas	839.54	J/mol×K	434.56	Calculated Property
Cp,gas	951.79	J/mol×K	515.33	Calculated Property
Cp,gas	1051.22	J/mol×K	596.11	Calculated Property
Cp,gas	1138.50	J/mol×K	676.89	Calculated Property
Cp,gas	1214.31	J/mol×K	757.67	Calculated Property
Cp,gas	1279.33	J/mol×K	838.44	Calculated Property
Cp,gas	1334.24	J/mol×K	919.22	Calculated Property
Cp,gas	1379.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006352; 0.0000391]	Pa×s	[504.91; 818.36]	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			-1.46417e+01
Coefficient B			3.67581e+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.			504.91
Temperature range, max.			818.36
η	0.0006352	Pa×s	504.91	Calculated Property
η	0.0003971	Pa×s	539.74	Calculated Property
η	0.0002628	Pa×s	574.57	Calculated Property
η	0.0001823	Pa×s	609.39	Calculated Property
η	0.0001316	Pa×s	644.22	Calculated Property
η	0.0000982	Pa×s	679.05	Calculated Property
η	0.0000754	Pa×s	713.88	Calculated Property
η	0.0000593	Pa×s	748.71	Calculated Property
η	0.0000477	Pa×s	783.53	Calculated Property
η	0.0000391	Pa×s	818.36	Calculated Property

Similar Compounds

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

Sources

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

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