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

Fumaric acid, 2-octyl 2,4,6-trichlorophenyl ester

InChI
InChI=1S/C18H21Cl3O4/c1-3-4-5-6-7-12(2)24-16(22)8-9-17(23)25-18-14(20)10-13(19)11-15(18)21/h8-12H,3-7H2,1-2H3/b9-8+
InChI Key
YICOYUMTYGGFAX-CMDGGOBGSA-N
Formula
C18H21Cl3O4
SMILES
CCCCCCC(C)OC(=O)/C=C/C(=O)Oc1c(Cl)cc(Cl)cc1Cl
Molecular Weight1
407.72
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Physical Properties

Property Value Unit Source
ΔfusH° 53.26 kJ/mol Joback Calculated Property
logPoct/wat 6.010 Crippen Calculated Property
McVol 288.020 ml/mol McGowan Calculated Property
Inp [2576.00; 2576.00]   Show Hide
Inp 2576.00 NIST
Inp 2576.00 NIST
Tboil 611.34 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 [797.83; 852.24] J/mol×K [885.51; 1102.37] Show Hide
Cp,gas 797.83 J/mol×K 885.51 Joback Calculated Property
Cp,gas 809.60 J/mol×K 921.65 Joback Calculated Property
Cp,gas 820.25 J/mol×K 957.80 Joback Calculated Property
Cp,gas 829.81 J/mol×K 993.94 Joback Calculated Property
Cp,gas 838.30 J/mol×K 1030.08 Joback Calculated Property
Cp,gas 845.77 J/mol×K 1066.22 Joback Calculated Property
Cp,gas 852.24 J/mol×K 1102.37 Joback Calculated Property
η [0.0000291; 0.0004084] Pa×s [510.94; 885.51] Show Hide
η 0.0004084 Pa×s 510.94 Joback Calculated Property
η 0.0002068 Pa×s 573.37 Joback Calculated Property
η 0.0001197 Pa×s 635.80 Joback Calculated Property
η 0.0000764 Pa×s 698.23 Joback Calculated Property
η 0.0000525 Pa×s 760.65 Joback Calculated Property
η 0.0000382 Pa×s 823.08 Joback Calculated Property
η 0.0000291 Pa×s 885.51 Joback Calculated Property

Similar Compounds

Fumaric acid, 2,4,6-trichlorophenyl hept-2-yl ester. Fumaric acid, 2,4,6-trichlorophenyl dec-2-yl 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-octyl 2,4,6-trichlorophenyl ester.

Sources

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