Chemical Properties of Fumaric acid, 4-bromophenyl 2-fluorophenyl ester

Fumaric acid, 4-bromophenyl 2-fluorophenyl ester

InChI
InChI=1S/C16H10BrFO4/c17-11-5-7-12(8-6-11)21-15(19)9-10-16(20)22-14-4-2-1-3-13(14)18/h1-10H/b10-9+
InChI Key
PBNWQAHQQRKUNI-MDZDMXLPSA-N
Formula
C16H10BrFO4
SMILES
O=C(/C=C/C(=O)Oc1ccccc1F)Oc1ccc(Br)cc1
Molecular Weight1
365.15
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Physical Properties

Property Value Unit Source
ΔfusH° 38.64 kJ/mol Joback Calculated Property
IE 8.75 eV Relay (1.0) Calculated Property
logPoct/wat 3.655 Crippen Calculated Property
McVol 218.630 ml/mol McGowan Calculated Property
Inp 2444.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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, 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 [569.04; 617.09] J/mol×K [850.97; 1095.42] Show Hide
Cp,gas 569.04 J/mol×K 850.97 Joback Calculated Property
Cp,gas 579.46 J/mol×K 891.71 Joback Calculated Property
Cp,gas 588.84 J/mol×K 932.45 Joback Calculated Property
Cp,gas 597.23 J/mol×K 973.19 Joback Calculated Property
Cp,gas 604.70 J/mol×K 1013.93 Joback Calculated Property
Cp,gas 611.30 J/mol×K 1054.68 Joback Calculated Property
Cp,gas 617.09 J/mol×K 1095.42 Joback Calculated Property

Similar Compounds

Fumaric acid, 4-bromophenyl 2-chloro-6-fluorophenyl ester. Fumaric acid, 4-methoxyphenyl 2-fluorophenyl ester. Fumaric acid, 4-chlorophenyl 2-fluorophenyl ester. Fumaric acid, naphth-2-yl 2-fluorophenyl ester. Fumaric acid, 3-chlorophenyl 2-fluorophenyl ester. Fumaric acid, naphth-1-yl 2-fluorophenyl ester. Fumaric acid, 2-methoxyphenyl 2-fluorophenyl ester. Fumaric acid, 2-chlorophenyl 2-fluorophenyl ester. Fumaric acid, 2,6-dichlorophenyl 2-fluorophenyl ester. Fumaric acid, 2,6-dimethoxyphenyl 2-fluorophenyl ester. Fumaric acid, 2,4,6-trichlorophenyl 2-fluorophenyl ester. Fumaric acid, 2,4-dichlorophenyl 2-fluorophenyl ester. Fumaric acid, 2,5-dichlorophenyl 2-fluorophenyl ester. Fumaric acid, monoamide, N,N-dimethyl-, 2-fluorophenyl ester. Fumaric acid, 4-chlorophenyl 2-chloro-6-fluorophenyl ester.

Find more compounds similar to Fumaric acid, 4-bromophenyl 2-fluorophenyl ester.

Sources

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