Chemical Properties of Fumaric acid, 2,6-dichlorophenyl 2-ethylhexyl ester

Fumaric acid, 2,6-dichlorophenyl 2-ethylhexyl ester

InChI
InChI=1S/C18H22Cl2O4/c1-3-5-7-13(4-2)12-23-16(21)10-11-17(22)24-18-14(19)8-6-9-15(18)20/h6,8-11,13H,3-5,7,12H2,1-2H3/b11-10+
InChI Key
IXVYZOIIOCRRTA-ZHACJKMWSA-N
Formula
C18H22Cl2O4
SMILES
CCCCC(CC)COC(=O)C=CC(=O)Oc1c(Cl)cccc1Cl
Molecular Weight1
373.27
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Physical Properties

Property Value Unit Source
ΔfusH° 49.45 kJ/mol Joback Calculated Property
IE 9.01 eV Relay (1.0) Calculated Property
log10WS -6.38 Relay (1.0) Calculated Property
logPoct/wat 5.215 Crippen Calculated Property
McVol 275.780 ml/mol McGowan Calculated Property
Pc 1425.07 kPa Joback Calculated Property
Inp [2481.00; 2481.00]   Show Hide
Inp 2481.00 NIST
Inp 2481.00 NIST
Tboil 610.95 K Relay (1.0) Calculated Property
Tfus 294.18 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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 [776.15; 838.73] J/mol×K [843.10; 1055.00] Show Hide
Cp,gas 776.15 J/mol×K 843.10 Joback Calculated Property
Cp,gas 789.27 J/mol×K 878.42 Joback Calculated Property
Cp,gas 801.27 J/mol×K 913.73 Joback Calculated Property
Cp,gas 812.18 J/mol×K 949.05 Joback Calculated Property
Cp,gas 822.04 J/mol×K 984.37 Joback Calculated Property
Cp,gas 830.88 J/mol×K 1019.69 Joback Calculated Property
Cp,gas 838.73 J/mol×K 1055.00 Joback Calculated Property
η [0.0000338; 0.0006225] Pa×s [468.50; 843.10] Show Hide
η 0.0006225 Pa×s 468.50 Joback Calculated Property
η 0.0002879 Pa×s 530.93 Joback Calculated Property
η 0.0001566 Pa×s 593.37 Joback Calculated Property
η 0.0000957 Pa×s 655.80 Joback Calculated Property
η 0.0000637 Pa×s 718.23 Joback Calculated Property
η 0.0000452 Pa×s 780.67 Joback Calculated Property
η 0.0000338 Pa×s 843.10 Joback Calculated Property

Similar Compounds

Fumaric acid, 2,4,6-trichlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-chlorophenyl 2-ethylhexyl ester. Fumaric acid, 2,4-dichlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-methylpentyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2-ethylhexyl 2,3-dichlorophenyl ester. Fumaric acid, 2,5-dichlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-ethylhexyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-(2-methoxyethyl)hexyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2-ethylbutyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2-ethylbutyl 2,3-dichlorophenyl ester. Fumaric acid, 2-methylpentyl 2,3-dichlorophenyl ester. Fumaric acid, 2-(2-methoxyethyl)hexyl 2,3-dichlorophenyl ester. Fumaric acid, 2-methylpentyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 3-chlorophenyl 2-ethylhexyl ester. Fumaric acid, 2-ethylbutyl 2-chloro-6-fluorophenyl ester.

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

Sources

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