Chemical Properties of Dimethylmalonic acid, di(2-chloro-6-fluorophenyl) ester

Dimethylmalonic acid, di(2-chloro-6-fluorophenyl) ester

InChI
InChI=1S/C17H12Cl2F2O4/c1-17(2,15(22)24-13-9(18)5-3-7-11(13)20)16(23)25-14-10(19)6-4-8-12(14)21/h3-8H,1-2H3
InChI Key
SPBYYSCSYSLWKH-UHFFFAOYSA-N
Formula
C17H12Cl2F2O4
SMILES
CC(C)(C(=O)Oc1c(F)cccc1Cl)C(=O)Oc1c(F)cccc1Cl
Molecular Weight1
389.18
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Physical Properties

Property Value Unit Source
ΔfusH° 39.03 kJ/mol Joback Calculated Property
IE 8.78 eV Relay (1.0) Calculated Property
logPoct/wat 4.809 Crippen Calculated Property
McVol 245.770 ml/mol McGowan Calculated Property
Inp [2462.00; 2462.00]   Show Hide
Inp 2462.00 NIST
Inp 2462.00 NIST
Tboil 590.79 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 [667.87; 712.15] J/mol×K [884.39; 1117.68] Show Hide
Cp,gas 667.87 J/mol×K 884.39 Joback Calculated Property
Cp,gas 677.84 J/mol×K 923.27 Joback Calculated Property
Cp,gas 686.72 J/mol×K 962.15 Joback Calculated Property
Cp,gas 694.55 J/mol×K 1001.04 Joback Calculated Property
Cp,gas 701.37 J/mol×K 1039.92 Joback Calculated Property
Cp,gas 707.22 J/mol×K 1078.80 Joback Calculated Property
Cp,gas 712.15 J/mol×K 1117.68 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, 2-chloro-6-fluorophenyl ethyl ester. Diethylmalonic acid, di(2-chloro-6-fluorophenyl) ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl propyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester. Dimethylmalonic acid, butyl 2-chloro-6-fluorophenyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl pentyl ester. Diethylmalonic acid, monochloride, 2-chloro-6-fluorophenyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl hexyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl dodecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl octyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl heptyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl pentadecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl decyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl tetradecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl tridecyl ester.

Find more compounds similar to Dimethylmalonic acid, di(2-chloro-6-fluorophenyl) ester.

Sources

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