Chemical Properties of Glutaric acid, hexa-1,5-dien-3-yl tridec-2-yn-1-yl ester

Glutaric acid, hexa-1,5-dien-3-yl tridec-2-yn-1-yl ester

InChI
InChI=1S/C24H38O4/c1-4-7-8-9-10-11-12-13-14-15-16-21-27-23(25)19-17-20-24(26)28-22(6-3)18-5-2/h5-6,22H,2-4,7-14,17-21H2,1H3
InChI Key
BIUSWQXTURENPE-UHFFFAOYSA-N
Formula
C24H38O4
SMILES
C=CCC(C=C)OC(=O)CCCC(=O)OCC#CCCCCCCCCCC
Molecular Weight1
390.56
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Physical Properties

Property Value Unit Source
ΔfusH° 63.69 kJ/mol Joback Calculated Property
ΔvapH° 109.76 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 5.908 Crippen Calculated Property
McVol 346.700 ml/mol McGowan Calculated Property
Inp [2653.00; 2653.00]   Show Hide
Inp 2653.00 NIST
Inp 2653.00 NIST
Tc 825.10 K Relay (1.0) Calculated Property
Tfus 266.39 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [510.46; 1156.12] 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 A4.17840e+01
Coefficient B1.99032e+00
Coefficient C-1.04946e-03
Coefficient D1.73480e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 510.46 J/mol×K 273.00 Calculated Property
Cp,gas 622.25 J/mol×K 353.78 Calculated Property
Cp,gas 722.75 J/mol×K 434.56 Calculated Property
Cp,gas 812.50 J/mol×K 515.33 Calculated Property
Cp,gas 892.06 J/mol×K 596.11 Calculated Property
Cp,gas 961.97 J/mol×K 676.89 Calculated Property
Cp,gas 1022.79 J/mol×K 757.67 Calculated Property
Cp,gas 1075.05 J/mol×K 838.44 Calculated Property
Cp,gas 1119.31 J/mol×K 919.22 Calculated Property
Cp,gas 1156.12 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, hexa-1,5-dien-3-yl hex-4-yn-3-yl ester. Glutaric acid, oct-1-en-3-yl tridec-2-yn-1-yl ester. Glutaric acid, hexa-1,5-dien-3-yl hept-2-yl ester. Glutaric acid, hexa-1,5-dien-3-yl dec-2-yl ester. Glutaric acid, hexa-1,5-dien-3-yl but-3-yn-2-yl ester. Glutaric acid, ethyl hexa-1,5-dien-3-yl ester. Glutaric acid, hexa-1,5-dien-3-yl dodec-2-en-1-yl ester. Glutaric acid, hexa-1,5-dien-3-yl 2,2-dichloroethyl ester. Glutaric acid, di(hexa-1,5-dien-3-yl) ester. Glutaric acid, but-3-en-2-yl tridec-2-yn-1-yl ester. Glutaric acid, hexa-1,5-dien-3-yl 2-ethylhexyl ester. Glutaric acid, hexa-1,5-dien-3-yl 3-methylbut-2-en-1-yl ester. Glutaric acid, hexa-1,5-dien-3-yl 8-chlorooctyl ester. Glutaric acid, hexa-1,5-dien-3-yl 3-methylbut-2-yl ester. Glutaric acid, hexa-1,5-dien-3-yl cyclohexylmethyl ester.

Find more compounds similar to Glutaric acid, hexa-1,5-dien-3-yl tridec-2-yn-1-yl ester.

Sources

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