Chemical Properties of Diethylmalonic acid, 2-fluorophenyl heptyl ester

Diethylmalonic acid, 2-fluorophenyl heptyl ester

InChI
InChI=1S/C20H29FO4/c1-4-7-8-9-12-15-24-18(22)20(5-2,6-3)19(23)25-17-14-11-10-13-16(17)21/h10-11,13-14H,4-9,12,15H2,1-3H3
InChI Key
MUCSPVQZPCGBHZ-UHFFFAOYSA-N
Formula
C20H29FO4
SMILES
CCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1F
Molecular Weight1
352.44
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Physical Properties

Property Value Unit Source
ΔfusH° 45.61 kJ/mol Joback Calculated Property
log10WS -5.29 Relay (1.0) Calculated Property
logPoct/wat 5.051 Crippen Calculated Property
McVol 285.550 ml/mol McGowan Calculated Property
Pc 1241.58 kPa Joback Calculated Property
Inp 2167.00 NIST
Tboil 606.08 K Relay (1.0) Calculated Property
Tfus 301.69 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 [873.12; 953.34] J/mol×K [801.34; 996.81] Show Hide
Cp,gas 873.12 J/mol×K 801.34 Joback Calculated Property
Cp,gas 889.28 J/mol×K 833.92 Joback Calculated Property
Cp,gas 904.27 J/mol×K 866.50 Joback Calculated Property
Cp,gas 918.13 J/mol×K 899.08 Joback Calculated Property
Cp,gas 930.91 J/mol×K 931.66 Joback Calculated Property
Cp,gas 942.63 J/mol×K 964.23 Joback Calculated Property
Cp,gas 953.34 J/mol×K 996.81 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 hexyl 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 heptyl ester.

Sources

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