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

Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-chlorophenyl ester

InChI
InChI=1S/C16H11ClFNO3/c17-11-5-1-4-8-14(11)22-16(21)10-9-15(20)19-13-7-3-2-6-12(13)18/h1-10H,(H,19,20)/b10-9+
InChI Key
BKMKJNOAVCAJBY-MDZDMXLPSA-N
Formula
C16H11ClFNO3
SMILES
O=C(C=CC(=O)Oc1ccccc1Cl)Nc1ccccc1F
Molecular Weight1
319.71
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 43.05 kJ/mol Joback Calculated Property
IE 8.39 eV Relay (1.0) Calculated Property
logPoct/wat 3.579 Crippen Calculated Property
McVol 217.480 ml/mol McGowan Calculated Property
Inp [2682.00; 2682.00]   Show Hide
Inp 2682.00 NIST
Inp 2682.00 NIST
Tfus 396.69 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 [582.10; 631.52] J/mol×K [832.12; 1069.40] Show Hide
Cp,gas 582.10 J/mol×K 832.12 Joback Calculated Property
Cp,gas 592.78 J/mol×K 871.67 Joback Calculated Property
Cp,gas 602.39 J/mol×K 911.21 Joback Calculated Property
Cp,gas 611.01 J/mol×K 950.76 Joback Calculated Property
Cp,gas 618.68 J/mol×K 990.31 Joback Calculated Property
Cp,gas 625.50 J/mol×K 1029.86 Joback Calculated Property
Cp,gas 631.52 J/mol×K 1069.40 Joback Calculated Property

Similar Compounds

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

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

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.