Chemical Properties of Diethylmalonic acid, 2-fluorophenyl propyl ester

Diethylmalonic acid, 2-fluorophenyl propyl ester

InChI
InChI=1S/C16H21FO4/c1-4-11-20-14(18)16(5-2,6-3)15(19)21-13-10-8-7-9-12(13)17/h7-10H,4-6,11H2,1-3H3
InChI Key
FDOZITGEMDIAIE-UHFFFAOYSA-N
Formula
C16H21FO4
SMILES
CCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1F
Molecular Weight1
296.33
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Physical Properties

Property Value Unit Source
ΔfusH° 35.25 kJ/mol Joback Calculated Property
log10WS -3.95 Relay (1.0) Calculated Property
logPoct/wat 3.491 Crippen Calculated Property
McVol 229.190 ml/mol McGowan Calculated Property
Pc 1660.55 kPa Joback Calculated Property
Inp [1810.00; 1810.00]   Show Hide
Inp 1810.00 NIST
Inp 1810.00 NIST
Tboil 568.69 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [647.66; 724.36] J/mol×K [709.82; 908.85] Show Hide
Cp,gas 647.66 J/mol×K 709.82 Joback Calculated Property
Cp,gas 663.04 J/mol×K 742.99 Joback Calculated Property
Cp,gas 677.34 J/mol×K 776.16 Joback Calculated Property
Cp,gas 690.59 J/mol×K 809.33 Joback Calculated Property
Cp,gas 702.82 J/mol×K 842.51 Joback Calculated Property
Cp,gas 714.06 J/mol×K 875.68 Joback Calculated Property
Cp,gas 724.36 J/mol×K 908.85 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, butyl 2-fluorophenyl ester. Diethylmalonic acid, ethyl 2-fluorophenyl ester. Diethylmalonic acid, 2-fluorophenyl isobutyl ester. Diethylmalonic acid, 2-fluorophenyl pentyl ester. Diethylmalonic acid, 3-fluorophenyl propyl ester. Diethylmalonic acid, 2-fluorophenyl heptadecyl ester. Diethylmalonic acid, 2-fluorophenyl tridecyl ester. Diethylmalonic acid, 2-fluorophenyl octadecyl ester. Diethylmalonic acid, 2-fluorophenyl octyl ester. Diethylmalonic acid, 2-fluorophenyl hexadecyl ester. Diethylmalonic acid, 2-fluorophenyl heptyl ester. Diethylmalonic acid, 2-fluorophenyl nonyl ester. Diethylmalonic acid, 2-fluorophenyl tetradecyl ester. Diethylmalonic acid, 2-fluorophenyl undecyl ester. Diethylmalonic acid, 2-fluorophenyl hexyl ester.

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

Sources

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