Chemical Properties of Fumaric acid, 2,4-dichlorophenyl 3-methylbut-2-en-1-yl ester

Fumaric acid, 2,4-dichlorophenyl 3-methylbut-2-en-1-yl ester

InChI
InChI=1S/C15H14Cl2O4/c1-10(2)7-8-20-14(18)5-6-15(19)21-13-4-3-11(16)9-12(13)17/h3-7,9H,8H2,1-2H3/b6-5+
InChI Key
FVXYZDHFPOCYNB-AATRIKPKSA-N
Formula
C15H14Cl2O4
SMILES
CC(C)=CCOC(=O)/C=C/C(=O)Oc1ccc(Cl)cc1Cl
Molecular Weight1
329.18
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Physical Properties

Property Value Unit Source
ΔfusH° 40.93 kJ/mol Joback Calculated Property
IE 8.78 eV Relay (1.0) Calculated Property
log10WS -5.78 Relay (1.0) Calculated Property
logPoct/wat 3.964 Crippen Calculated Property
McVol 229.210 ml/mol McGowan Calculated Property
Inp [2283.00; 2283.00]   Show Hide
Inp 2283.00 NIST
Inp 2283.00 NIST
Tboil 604.62 K Relay (1.0) Calculated Property
Tfus 338.62 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 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 [590.33; 647.18] J/mol×K [814.88; 1042.21] Show Hide
Cp,gas 590.33 J/mol×K 814.88 Joback Calculated Property
Cp,gas 601.88 J/mol×K 852.77 Joback Calculated Property
Cp,gas 612.54 J/mol×K 890.66 Joback Calculated Property
Cp,gas 622.36 J/mol×K 928.55 Joback Calculated Property
Cp,gas 631.38 J/mol×K 966.44 Joback Calculated Property
Cp,gas 639.64 J/mol×K 1004.32 Joback Calculated Property
Cp,gas 647.18 J/mol×K 1042.21 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-chlorophenyl 3-methylbut-2-en-1-yl ester. Fumaric acid, 2,5-dichlorophenyl 3-methylbut-2-en-1-yl ester. Fumaric acid, 2,4,6-trichlorophenyl 3-methylbut-2-en-1-yl ester. Fumaric acid, 2,4-dichlorophenyl dodec-2-en-1-yl ester. Fumaric acid, 2,4-dichlorophenyl 2,2-dichloroethyl ester. Fumaric acid, 4-methoxyphenyl 3-methylbut-2-en-1-yl ester. Fumaric acid, 2-chlorophenyl dodec-2-en-1-yl ester. Fumaric acid, naphth-2-yl 3-methylbut-2-en-1-yl ester. Fumaric acid, ethyl 2,4,5-trichlorophenyl ester. Fumaric acid, 4-bromophenyl 3-methylbut-2-en-1-yl ester. Fumaric acid, 2-chlorophenyl 2,2-dichloroethyl ester. Fumaric acid, 2-methoxyphenyl 3-methylbut-2-en-1-yl ester. Fumaric acid, naphth-1-yl 3-methylbut-2-en-1-yl ester. Fumaric acid, propyl 2,4,5-trichlorophenyl ester. Fumaric acid, 2,4-dichlorophenyl 3-methylbut-2-yl ester.

Find more compounds similar to Fumaric acid, 2,4-dichlorophenyl 3-methylbut-2-en-1-yl ester.

Sources

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