Chemical Properties of 3-Methylbut-2-enoic acid, 2,4,5-trichlorophenyl ester

3-Methylbut-2-enoic acid, 2,4,5-trichlorophenyl ester

InChI
InChI=1S/C11H9Cl3O2/c1-6(2)3-11(15)16-10-5-8(13)7(12)4-9(10)14/h3-5H,1-2H3
InChI Key
RIWFJYJVQGPRGX-UHFFFAOYSA-N
Formula
C11H9Cl3O2
SMILES
CC(C)=CC(=O)Oc1cc(Cl)c(Cl)cc1Cl
Molecular Weight1
279.55
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Physical Properties

Property Value Unit Source
ΔfusH° 32.97 kJ/mol Joback Calculated Property
IE 8.52 eV Relay (1.0) Calculated Property
log10WS -5.50 Relay (1.0) Calculated Property
logPoct/wat 4.518 Crippen Calculated Property
McVol 181.950 ml/mol McGowan Calculated Property
Inp 1900.00 NIST
Tboil 557.65 K Relay (1.0) Calculated Property
Tfus 356.47 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 [393.54; 446.44] J/mol×K [667.45; 901.53] Show Hide
Cp,gas 393.54 J/mol×K 667.45 Joback Calculated Property
Cp,gas 404.29 J/mol×K 706.46 Joback Calculated Property
Cp,gas 414.22 J/mol×K 745.48 Joback Calculated Property
Cp,gas 423.37 J/mol×K 784.49 Joback Calculated Property
Cp,gas 431.77 J/mol×K 823.50 Joback Calculated Property
Cp,gas 439.44 J/mol×K 862.52 Joback Calculated Property
Cp,gas 446.44 J/mol×K 901.53 Joback Calculated Property

Similar Compounds

3-Methylbut-2-enoic acid, 2,3,4,6-tetrachlorophenyl ester. 3-Methylbut-2-enoic acid, 3,4-dichlorophenyl ester. Fumaric acid, ethyl 2,4,5-trichlorophenyl ester. Fumaric acid, 2,4-dichlorophenyl 3-chlorophenyl ester. Phenol, 2,4,5-trichloro-, acetate. Methacrylic acid, 2,4,5-trichlorophenyl ester. Fumaric acid, 2,5-dichlorophenyl 3-chlorophenyl ester. Fumaric acid, 3-chlorophenyl 2,4,6-trichlorophenyl ester. Fumaric acid, di(2,3,5-trichlorophenyl) ester. Fumaric acid, 4-chlorophenyl 2,3-dichlorophenyl ester. 3-Methylbut-2-enoic acid, 4-chlorophenyl ester. Fumaric acid, 3-chlorophenyl 2,3-dichlorophenyl ester. Fumaric acid, 2-chlorophenyl 2,3-dichlorophenyl ester. Fumaric acid, propyl 2,4,5-trichlorophenyl ester. Fumaric acid, 2,5-dichlorophenyl 3-methylbut-2-en-1-yl ester.

Find more compounds similar to 3-Methylbut-2-enoic acid, 2,4,5-trichlorophenyl ester.

Sources

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