Chemical Properties of Fumaric acid, 2,6-dimethoxyphenyl 2-fluorophenyl ester

Fumaric acid, 2,6-dimethoxyphenyl 2-fluorophenyl ester

InChI
InChI=1S/C18H15FO6/c1-22-14-8-5-9-15(23-2)18(14)25-17(21)11-10-16(20)24-13-7-4-3-6-12(13)19/h3-11H,1-2H3/b11-10-
InChI Key
GPRRCJQCBVYZMB-ZHACJKMWSA-N
Formula
C18H15FO6
SMILES
COc1cccc(OC)c1OC(=O)/C=C/C(=O)Oc1ccccc1F
Molecular Weight1
346.31
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Physical Properties

Property Value Unit Source
ΔfusH° 43.69 kJ/mol Joback Calculated Property
ΔvapH° 112.13 kJ/mol Relay (1.0) Calculated Property
IE 8.27 eV Relay (1.0) Calculated Property
log10WS -4.52 Relay (1.0) Calculated Property
logPoct/wat 2.910 Crippen Calculated Property
McVol 241.050 ml/mol McGowan Calculated Property
Tboil 647.47 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, Standard Gibbs free energy of formation, Acentric Factor 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 [690.69; 741.88] J/mol×K [844.45; 1066.74] Show Hide
Cp,gas 690.69 J/mol×K 844.45 Joback Calculated Property
Cp,gas 702.53 J/mol×K 881.50 Joback Calculated Property
Cp,gas 713.04 J/mol×K 918.55 Joback Calculated Property
Cp,gas 722.23 J/mol×K 955.59 Joback Calculated Property
Cp,gas 730.09 J/mol×K 992.64 Joback Calculated Property
Cp,gas 736.64 J/mol×K 1029.69 Joback Calculated Property
Cp,gas 741.88 J/mol×K 1066.74 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-methoxyphenyl 2-fluorophenyl ester. Fumaric acid, 2,6-dimethoxyphenyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 2-methoxyphenyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-methoxyphenyl 2-fluorophenyl ester. Fumaric acid, 2,6-dimethoxyphenyl 3-chlorophenyl ester. Fumaric acid, di(2-methoxyphenyl) ester. Fumaric acid, 2,6-dimethoxyphenyl 2,3-dichlorophenyl ester. Fumaric acid, 4-bromophenyl 2-fluorophenyl ester. Fumaric acid, 2-methoxyphenyl 2,4,6-trichlorophenyl ester. Glutaric acid, 2-fluorophenyl 2,6-dimethoxyphenyl ester. Fumaric acid, 2,6-dimethoxyphenyl 2,2-dichloroethyl ester. Succinic acid, 2-fluorophenyl 2-methoxyphenyl ester. Fumaric acid, 2-methoxyphenyl 3-chlorophenyl ester. Fumaric acid, 2-methoxyphenyl 2,2-dichloroethyl ester. Succinic acid, 2-fluorophenyl 4-bromo-2-methoxyphenyl ester.

Find more compounds similar to Fumaric acid, 2,6-dimethoxyphenyl 2-fluorophenyl ester.

Sources

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