Chemical Properties of Sebacic acid, di(pent-4-en-2-yl) ester

InChI

InChI=1S/C20H34O4/c1-5-13-17(3)23-19(21)15-11-9-7-8-10-12-16-20(22)24-18(4)14-6-2/h5-6,17-18H,1-2,7-16H2,3-4H3

InChI Key

KRIHJLVYCYLOBE-UHFFFAOYSA-N

Formula

C20H34O4

SMILES

C=CCC(C)OC(=O)CCCCCCCCC(=O)OC(C)CC=C

Molecular Weight¹

338.49

• 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	[442.18; 1011.42]	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			2.61800e+01
Coefficient B			1.76604e+00
Coefficient C			-9.27200e-04
Coefficient D			1.46400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	442.18	J/mol×K	273.00	Calculated Property
Cp,gas	541.40	J/mol×K	353.78	Calculated Property
Cp,gas	630.55	J/mol×K	434.56	Calculated Property
Cp,gas	710.08	J/mol×K	515.33	Calculated Property
Cp,gas	780.47	J/mol×K	596.11	Calculated Property
Cp,gas	842.17	J/mol×K	676.89	Calculated Property
Cp,gas	895.66	J/mol×K	757.67	Calculated Property
Cp,gas	941.39	J/mol×K	838.44	Calculated Property
Cp,gas	979.82	J/mol×K	919.22	Calculated Property
Cp,gas	1011.42	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0025844; 0.0000732]	Pa×s	[366.30; 662.83]	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			-1.39255e+01
Coefficient B			2.91840e+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.			366.30
Temperature range, max.			662.83
η	0.0025844	Pa×s	366.30	Calculated Property
η	0.0013391	Pa×s	399.25	Calculated Property
η	0.0007670	Pa×s	432.20	Calculated Property
η	0.0004754	Pa×s	465.14	Calculated Property
η	0.0003139	Pa×s	498.09	Calculated Property
η	0.0002182	Pa×s	531.04	Calculated Property
η	0.0001583	Pa×s	563.99	Calculated Property
η	0.0001190	Pa×s	596.94	Calculated Property
η	0.0000921	Pa×s	629.88	Calculated Property
η	0.0000732	Pa×s	662.83	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, di(pent-4-en-2-yl) 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.