Chemical Properties of Diethylmalonic acid, 2-chloro-6-fluorophenyl dodecyl ester

Diethylmalonic acid, 2-chloro-6-fluorophenyl dodecyl ester

InChI
InChI=1S/C25H38ClFO4/c1-4-7-8-9-10-11-12-13-14-15-19-30-23(28)25(5-2,6-3)24(29)31-22-20(26)17-16-18-21(22)27/h16-18H,4-15,19H2,1-3H3
InChI Key
JRATWILPMMZWSV-UHFFFAOYSA-N
Formula
C25H38ClFO4
SMILES
CCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1c(F)cccc1Cl
Molecular Weight1
457.02
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Physical Properties

Property Value Unit Source
ΔfusH° 59.21 kJ/mol Joback Calculated Property
logPoct/wat 7.655 Crippen Calculated Property
McVol 368.240 ml/mol McGowan Calculated Property
Inp [2873.00; 2873.00]   Show Hide
Inp 2873.00 NIST
Inp 2873.00 NIST
Tboil 643.27 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, 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 [1213.72; 1289.73] J/mol×K [994.09; 1217.22] Show Hide
Cp,gas 1213.72 J/mol×K 994.09 Joback Calculated Property
Cp,gas 1229.62 J/mol×K 1031.28 Joback Calculated Property
Cp,gas 1244.13 J/mol×K 1068.47 Joback Calculated Property
Cp,gas 1257.33 J/mol×K 1105.66 Joback Calculated Property
Cp,gas 1269.28 J/mol×K 1142.84 Joback Calculated Property
Cp,gas 1280.06 J/mol×K 1180.03 Joback Calculated Property
Cp,gas 1289.73 J/mol×K 1217.22 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 2-chloro-6-fluorophenyl tetradecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hexadecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl pentadecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl octyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl undecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl decyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hepyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl tridecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hexyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl pentyl ester. Diethylmalonic acid, butyl 2-chloro-6-fluorophenyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl propyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl tridecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl heptadecyl ester.

Find more compounds similar to Diethylmalonic acid, 2-chloro-6-fluorophenyl dodecyl ester.

Sources

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