Chemical Properties of Dimethylmalonic acid, propyl 2,4,6-trichlorophenyl ester

Dimethylmalonic acid, propyl 2,4,6-trichlorophenyl ester

InChI
InChI=1S/C14H15Cl3O4/c1-4-5-20-12(18)14(2,3)13(19)21-11-9(16)6-8(15)7-10(11)17/h6-7H,4-5H2,1-3H3
InChI Key
VULSHHCHBHVVTO-UHFFFAOYSA-N
Formula
C14H15Cl3O4
SMILES
CCCOC(=O)C(C)(C)C(=O)Oc1c(Cl)cc(Cl)cc1Cl
Molecular Weight1
353.62
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Physical Properties

Property Value Unit Source
ΔfH°gas -760.97 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 35.64 kJ/mol Joback Calculated Property
ΔvapH° 86.44 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.532 Crippen Calculated Property
McVol 235.960 ml/mol McGowan Calculated Property
Inp [2085.00; 2085.00]   Show Hide
Inp 2085.00 NIST
Inp 2085.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 [611.60; 663.93] J/mol×K [822.98; 1049.66] Show Hide
Cp,gas 611.60 J/mol×K 822.98 Joback Calculated Property
Cp,gas 622.67 J/mol×K 860.76 Joback Calculated Property
Cp,gas 632.78 J/mol×K 898.54 Joback Calculated Property
Cp,gas 641.93 J/mol×K 936.32 Joback Calculated Property
Cp,gas 650.15 J/mol×K 974.10 Joback Calculated Property
Cp,gas 657.48 J/mol×K 1011.88 Joback Calculated Property
Cp,gas 663.93 J/mol×K 1049.66 Joback Calculated Property
η [0.0000672; 0.0004186] Pa×s [548.02; 822.98] Show Hide
η 0.0004186 Pa×s 548.02 Joback Calculated Property
η 0.0002744 Pa×s 593.85 Joback Calculated Property
η 0.0001911 Pa×s 639.67 Joback Calculated Property
η 0.0001397 Pa×s 685.50 Joback Calculated Property
η 0.0001062 Pa×s 731.33 Joback Calculated Property
η 0.0000834 Pa×s 777.15 Joback Calculated Property
η 0.0000672 Pa×s 822.98 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, isobutyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, butyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, ethyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, pentyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, hexyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, 2,4,6-trichlorophenyl undecyl ester. Dimethylmalonic acid, nonyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, 2,4,6-trichlorophenyl tridecyl ester. Dimethylmalonic acid, octyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, heptyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, heptadecyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, hexadecyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, decyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, pentadecyl 2,4,6-trichlorophenyl ester. Dimethylmalonic acid, 2,3-dichlorophenyl propyl ester.

Find more compounds similar to Dimethylmalonic acid, propyl 2,4,6-trichlorophenyl ester.

Sources

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