Chemical Properties of Fumaric acid, 2,4,6-trichlorophenyl hept-2-yl ester

Fumaric acid, 2,4,6-trichlorophenyl hept-2-yl ester

InChI
InChI=1S/C17H19Cl3O4/c1-3-4-5-6-11(2)23-15(21)7-8-16(22)24-17-13(19)9-12(18)10-14(17)20/h7-11H,3-6H2,1-2H3/b8-7+
InChI Key
QEHXDBTXKAHXSJ-BQYQJAHWSA-N
Formula
C17H19Cl3O4
SMILES
CCCCCC(C)OC(=O)C=CC(=O)Oc1c(Cl)cc(Cl)cc1Cl
Molecular Weight1
393.69
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Physical Properties

Property Value Unit Source
ΔfusH° 47.50 kJ/mol Joback Calculated Property
logPoct/wat 5.620 Crippen Calculated Property
McVol 273.930 ml/mol McGowan Calculated Property
Inp [2475.00; 2475.00]   Show Hide
Inp 2475.00 NIST
Inp 2475.00 NIST
Tboil 599.08 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [749.43; 803.64] J/mol×K [898.57; 1120.45] Show Hide
Cp,gas 749.43 J/mol×K 898.57 Joback Calculated Property
Cp,gas 760.93 J/mol×K 935.55 Joback Calculated Property
Cp,gas 771.40 J/mol×K 972.53 Joback Calculated Property
Cp,gas 780.88 J/mol×K 1009.51 Joback Calculated Property
Cp,gas 789.39 J/mol×K 1046.49 Joback Calculated Property
Cp,gas 796.97 J/mol×K 1083.47 Joback Calculated Property
Cp,gas 803.64 J/mol×K 1120.45 Joback Calculated Property
η [0.0000442; 0.0003475] Pa×s [559.33; 898.57] Show Hide
η 0.0003475 Pa×s 559.33 Joback Calculated Property
η 0.0002104 Pa×s 615.87 Joback Calculated Property
η 0.0001387 Pa×s 672.41 Joback Calculated Property
η 0.0000975 Pa×s 728.95 Joback Calculated Property
η 0.0000721 Pa×s 785.49 Joback Calculated Property
η 0.0000555 Pa×s 842.03 Joback Calculated Property
η 0.0000442 Pa×s 898.57 Joback Calculated Property

Similar Compounds

Fumaric acid, 2,4,6-trichlorophenyl dec-2-yl ester. Fumaric acid, 2-octyl 2,4,6-trichlorophenyl ester. Fumaric acid, 4-octyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2,6-dichlorophenyl hept-2-yl ester. Fumaric acid, 2,4-dichlorophenyl dec-2-yl ester. Fumaric acid, 2,4-dichlorophenyl hept-2-yl ester. Fumaric acid, 2-chlorophenyl hept-2-yl ester. Fumaric acid, 2-octyl 2,3-dichlorophenyl ester. Fumaric acid, 2,5-dichlorophenyl hept-2-yl ester. Fumaric acid, 2,5-dichlorophenyl dec-2-yl ester. Fumaric acid, octyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2,4,6-trichlorophenyl tridecyl ester. Fumaric acid, heptyl 2,4,6-trichlorophenyl ester. Fumaric acid, pentadecyl 2,4,6-trichlorophenyl ester. Fumaric acid, hexadecyl 2,4,6-trichlorophenyl ester.

Find more compounds similar to Fumaric acid, 2,4,6-trichlorophenyl hept-2-yl ester.

Sources

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