Chemical Properties of Fumaric acid, monoamide, N-(2-bromophenyl)-, 3-fluorophenyl ester

Fumaric acid, monoamide, N-(2-bromophenyl)-, 3-fluorophenyl ester

InChI
InChI=1S/C16H11BrFNO3/c17-13-6-1-2-7-14(13)19-15(20)8-9-16(21)22-12-5-3-4-11(18)10-12/h1-10H,(H,19,20)/b9-8+
InChI Key
JQMXYAJTDHWLIV-CMDGGOBGSA-N
Formula
C16H11BrFNO3
SMILES
O=C(C=CC(=O)Oc1cccc(F)c1)Nc1ccccc1Br
Molecular Weight1
364.17
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Physical Properties

Property Value Unit Source
ΔfusH° 44.13 kJ/mol Joback Calculated Property
IE 8.39 eV Relay (1.0) Calculated Property
logPoct/wat 3.688 Crippen Calculated Property
McVol 222.740 ml/mol McGowan Calculated Property
Inp [2752.00; 2752.00]   Show Hide
Inp 2752.00 NIST
Inp 2752.00 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 [590.52; 637.88] J/mol×K [860.85; 1104.77] Show Hide
Cp,gas 590.52 J/mol×K 860.85 Joback Calculated Property
Cp,gas 600.68 J/mol×K 901.50 Joback Calculated Property
Cp,gas 609.82 J/mol×K 942.16 Joback Calculated Property
Cp,gas 618.02 J/mol×K 982.81 Joback Calculated Property
Cp,gas 625.38 J/mol×K 1023.47 Joback Calculated Property
Cp,gas 631.97 J/mol×K 1064.12 Joback Calculated Property
Cp,gas 637.88 J/mol×K 1104.77 Joback Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-fluorophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 3,5-difluorophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-bromo-4-fluorophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-chlorophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 4-isopropoxyphenyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 3-fluorophenyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 4-bromophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2,4,6-trichlorophenyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 3-fluorophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 4-chloro-3-methylphenyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-bromo-4-fluorophenyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 4-chloro-2-methylphenyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 3,5-difluorophenyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-fluorophenyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-chlorophenyl ester.

Find more compounds similar to Fumaric acid, monoamide, N-(2-bromophenyl)-, 3-fluorophenyl ester.

Sources

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