Chemical Properties of Diethylmalonic acid, 2-fluorophenyl hexyl ester

Diethylmalonic acid, 2-fluorophenyl hexyl ester

InChI
InChI=1S/C19H27FO4/c1-4-7-8-11-14-23-17(21)19(5-2,6-3)18(22)24-16-13-10-9-12-15(16)20/h9-10,12-13H,4-8,11,14H2,1-3H3
InChI Key
KBYRKTJGIDRLAC-UHFFFAOYSA-N
Formula
C19H27FO4
SMILES
CCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1F
Molecular Weight1
338.41
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Physical Properties

Property Value Unit Source
ΔfusH° 43.02 kJ/mol Joback Calculated Property
log10WS -4.94 Relay (1.0) Calculated Property
logPoct/wat 4.661 Crippen Calculated Property
McVol 271.460 ml/mol McGowan Calculated Property
Pc 1330.04 kPa Joback Calculated Property
Inp 2073.00 NIST
Tboil 597.34 K Relay (1.0) Calculated Property
Tfus 298.98 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [815.36; 894.93] J/mol×K [778.46; 973.99] Show Hide
Cp,gas 815.36 J/mol×K 778.46 Joback Calculated Property
Cp,gas 831.36 J/mol×K 811.05 Joback Calculated Property
Cp,gas 846.21 J/mol×K 843.64 Joback Calculated Property
Cp,gas 859.96 J/mol×K 876.22 Joback Calculated Property
Cp,gas 872.63 J/mol×K 908.81 Joback Calculated Property
Cp,gas 884.28 J/mol×K 941.40 Joback Calculated Property
Cp,gas 894.93 J/mol×K 973.99 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 2-fluorophenyl octyl ester. Diethylmalonic acid, 2-fluorophenyl tetradecyl ester. Diethylmalonic acid, 2-fluorophenyl tridecyl ester. Diethylmalonic acid, dodecyl 2-fluorophenyl ester. Diethylmalonic acid, 2-fluorophenyl undecyl ester. Diethylmalonic acid, 2-fluorophenyl heptyl ester. Diethylmalonic acid, 2-fluorophenyl nonyl ester. Diethylmalonic acid, 2-fluorophenyl pentadecyl ester. Diethylmalonic acid, decyl 2-fluorophenyl ester. Diethylmalonic acid, 2-fluorophenyl octadecyl ester. Diethylmalonic acid, 2-fluorophenyl heptadecyl ester. Diethylmalonic acid, 2-fluorophenyl hexadecyl ester. Diethylmalonic acid, 2-fluorophenyl pentyl ester. Diethylmalonic acid, butyl 2-fluorophenyl ester. Diethylmalonic acid, dodecyl 3-fluorophenyl ester.

Find more compounds similar to Diethylmalonic acid, 2-fluorophenyl hexyl ester.

Sources

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