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

Fumaric acid, 2,6-dichlorophenyl hept-2-yl ester

InChI
InChI=1S/C17H20Cl2O4/c1-3-4-5-7-12(2)22-15(20)10-11-16(21)23-17-13(18)8-6-9-14(17)19/h6,8-12H,3-5,7H2,1-2H3/b11-10+
InChI Key
QYMWSNKZHALFEA-ZHACJKMWSA-N
Formula
C17H20Cl2O4
SMILES
CCCCCC(C)OC(=O)/C=C/C(=O)Oc1c(Cl)cccc1Cl
Molecular Weight1
359.25
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Physical Properties

Property Value Unit Source
ΔfusH° 43.70 kJ/mol Joback Calculated Property
IE 9.16 eV Relay (1.0) Calculated Property
logPoct/wat 4.967 Crippen Calculated Property
McVol 261.690 ml/mol McGowan Calculated Property
Inp [2358.00; 2358.00]   Show Hide
Inp 2358.00 NIST
Inp 2358.00 NIST
Tboil 596.20 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, 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 [728.69; 790.29] J/mol×K [856.16; 1073.35] Show Hide
Cp,gas 728.69 J/mol×K 856.16 Joback Calculated Property
Cp,gas 741.40 J/mol×K 892.36 Joback Calculated Property
Cp,gas 753.09 J/mol×K 928.56 Joback Calculated Property
Cp,gas 763.80 J/mol×K 964.76 Joback Calculated Property
Cp,gas 773.55 J/mol×K 1000.95 Joback Calculated Property
Cp,gas 782.37 J/mol×K 1037.15 Joback Calculated Property
Cp,gas 790.29 J/mol×K 1073.35 Joback Calculated Property
η [0.0000507; 0.0004807] Pa×s [516.89; 856.16] Show Hide
η 0.0004807 Pa×s 516.89 Joback Calculated Property
η 0.0002746 Pa×s 573.44 Joback Calculated Property
η 0.0001735 Pa×s 629.98 Joback Calculated Property
η 0.0001182 Pa×s 686.53 Joback Calculated Property
η 0.0000854 Pa×s 743.07 Joback Calculated Property
η 0.0000646 Pa×s 799.62 Joback Calculated Property
η 0.0000507 Pa×s 856.16 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, 2-octyl 2,4,6-trichlorophenyl ester. Fumaric acid, 4-octyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2-chlorophenyl 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-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, 4-octyl 2,3-dichlorophenyl ester. Fumaric acid, 2-octyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-octyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-chlorophenyl hept-2-yl ester. Fumaric acid, 2-pentyl 2,3-dichlorophenyl ester.

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

Sources

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