Chemical Properties of Glutaric acid, 2-ethylhexyl 2,6-dimethylnon-1-en-3-yn-5-yl ester

Glutaric acid, 2-ethylhexyl 2,6-dimethylnon-1-en-3-yn-5-yl ester

InChI
InChI=1S/C24H40O4/c1-7-10-13-21(9-3)18-27-23(25)14-11-15-24(26)28-22(17-16-19(4)5)20(6)12-8-2/h20-22H,4,7-15,18H2,1-3,5-6H3
InChI Key
TYHBDRKGLMFQSE-UHFFFAOYSA-N
Formula
C24H40O4
SMILES
C=C(C)C#CC(OC(=O)CCCC(=O)OCC(CC)CCCC)C(C)CCC
Molecular Weight1
392.57
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Physical Properties

Property Value Unit Source
ΔfusH° 56.62 kJ/mol Joback Calculated Property
ΔvapH° 103.64 kJ/mol Relay (1.0) Calculated Property
log10WS -5.53 Relay (1.0) Calculated Property
logPoct/wat 5.844 Crippen Calculated Property
McVol 351.000 ml/mol McGowan Calculated Property
Inp [2398.00; 2398.00]   Show Hide
Inp 2398.00 NIST
Inp 2398.00 NIST
Tboil 631.17 K Relay (1.0) Calculated Property
Tc 809.67 K Relay (1.0) Calculated Property
Tfus 243.72 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, 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 [519.79; 1185.44] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A4.17200e+01
Coefficient B2.02210e+00
Coefficient C-1.03526e-03
Coefficient D1.56880e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 519.79 J/mol×K 273.00 Calculated Property
Cp,gas 634.47 J/mol×K 353.78 Calculated Property
Cp,gas 737.81 J/mol×K 434.56 Calculated Property
Cp,gas 830.31 J/mol×K 515.33 Calculated Property
Cp,gas 912.47 J/mol×K 596.11 Calculated Property
Cp,gas 984.78 J/mol×K 676.89 Calculated Property
Cp,gas 1047.73 J/mol×K 757.67 Calculated Property
Cp,gas 1101.83 J/mol×K 838.44 Calculated Property
Cp,gas 1147.57 J/mol×K 919.22 Calculated Property
Cp,gas 1185.44 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, cyclohexylmethyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl isobutyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl heptyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl tetradecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl hexadecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl tridecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl pentadecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl undecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl nonyl ester. Glutaric acid, decyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl octyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl dodecyl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl hexyl ester. Glutaric acid, butyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. Glutaric acid, 2,6-dimethylnon-1-en-3-yn-5-yl pentyl ester.

Find more compounds similar to Glutaric acid, 2-ethylhexyl 2,6-dimethylnon-1-en-3-yn-5-yl ester.

Sources

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