Chemical Properties of Fumaric acid, monoamide, N-(2-bromophenyl)-, 3,5-difluorophenyl ester

Fumaric acid, monoamide, N-(2-bromophenyl)-, 3,5-difluorophenyl ester

InChI
InChI=1S/C16H10BrF2NO3/c17-13-3-1-2-4-14(13)20-15(21)5-6-16(22)23-12-8-10(18)7-11(19)9-12/h1-9H,(H,20,21)/b6-5+
InChI Key
IDSBBDZGAFTYLY-AATRIKPKSA-N
Formula
C16H10BrF2NO3
SMILES
O=C(C=CC(=O)Oc1cc(F)cc(F)c1)Nc1ccccc1Br
Molecular Weight1
382.16
Other Names
  • Fumaric acid, monoamide, N-(2-bromophenyl)-, 3,5-fluorophenyl ester
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Physical Properties

Property Value Unit Source
ΔfusH° 46.82 kJ/mol Joback Calculated Property
IE 8.55 eV Relay (1.0) Calculated Property
logPoct/wat 3.828 Crippen Calculated Property
McVol 224.510 ml/mol McGowan Calculated Property
Inp [2669.00; 2669.00]   Show Hide
Inp 2669.00 NIST
Inp 2669.00 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 [596.16; 640.88] J/mol×K [865.10; 1101.22] Show Hide
Cp,gas 596.16 J/mol×K 865.10 Joback Calculated Property
Cp,gas 605.77 J/mol×K 904.45 Joback Calculated Property
Cp,gas 614.42 J/mol×K 943.81 Joback Calculated Property
Cp,gas 622.19 J/mol×K 983.16 Joback Calculated Property
Cp,gas 629.14 J/mol×K 1022.51 Joback Calculated Property
Cp,gas 635.35 J/mol×K 1061.87 Joback Calculated Property
Cp,gas 640.88 J/mol×K 1101.22 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to Fumaric acid, monoamide, N-(2-bromophenyl)-, 3,5-difluorophenyl ester.

Sources

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