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

3-Methylbut-2-enoic acid, 3,4-dichlorophenyl ester

InChI
InChI=1S/C11H10Cl2O2/c1-7(2)5-11(14)15-8-3-4-9(12)10(13)6-8/h3-6H,1-2H3
InChI Key
ZFPKWERGBZSOTQ-UHFFFAOYSA-N
Formula
C11H10Cl2O2
SMILES
CC(C)=CC(=O)Oc1ccc(Cl)c(Cl)c1
Molecular Weight1
245.11
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Physical Properties

Property Value Unit Source
ΔfusH° 29.16 kJ/mol Joback Calculated Property
IE 8.56 eV Relay (1.0) Calculated Property
log10WS -4.93 Relay (1.0) Calculated Property
logPoct/wat 3.865 Crippen Calculated Property
McVol 169.710 ml/mol McGowan Calculated Property
Inp [1725.00; 1725.00]   Show Hide
Inp 1725.00 NIST
Inp 1725.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [215.97; 456.02] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.49000e+01
Coefficient B8.29640e-01
Coefficient C-5.04020e-04
Coefficient D1.05500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 215.97 J/mol×K 273.00 Calculated Property
Cp,gas 260.00 J/mol×K 353.78 Calculated Property
Cp,gas 298.90 J/mol×K 434.56 Calculated Property
Cp,gas 333.03 J/mol×K 515.33 Calculated Property
Cp,gas 362.70 J/mol×K 596.11 Calculated Property
Cp,gas 388.26 J/mol×K 676.89 Calculated Property
Cp,gas 410.04 J/mol×K 757.67 Calculated Property
Cp,gas 428.37 J/mol×K 838.44 Calculated Property
Cp,gas 443.59 J/mol×K 919.22 Calculated Property
Cp,gas 456.02 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Methylbut-2-enoic acid, 4-chlorophenyl ester. 3-Methylbut-2-enoic acid, 2,4,5-trichlorophenyl ester. Fumaric acid, 4-chlorophenyl 3-chlorophenyl ester. Phenol, 3,4-dichloro-, acetate. Fumaric acid, di(3,4,5-trichlorophenyl) ester. 3-Methylbut-2-enoic acid, 2,3,4,6-tetrachlorophenyl ester. Fumaric acid, 4-chlorophenyl 2,3-dichlorophenyl ester. Fumaric acid, 2,4-dichlorophenyl 3-chlorophenyl ester. Fumaric acid, 3-chlorophenyl 2,3-dichlorophenyl ester. Fumaric acid, 3-chlorophenyl 2,4,6-trichlorophenyl ester. Fumaric acid, 2-chlorophenyl 2,3-dichlorophenyl ester. Fumaric acid, 2,5-dichlorophenyl 3-chlorophenyl ester. Bromoacetic acid, 3,4-dichlorophenyl ester. Chloroacetic acid, 3,4-dichlorophenyl ester. Dichloroacetic acid, 3,4-dichlorophenyl ester.

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

Sources

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