Chemical Properties of Fumaric acid, 2,4,6-trichlorophenyl 2-fluorophenyl ester

Fumaric acid, 2,4,6-trichlorophenyl 2-fluorophenyl ester

InChI
InChI=1S/C16H8Cl3FO4/c17-9-7-10(18)16(11(19)8-9)24-15(22)6-5-14(21)23-13-4-2-1-3-12(13)20/h1-8H/b6-5+
InChI Key
HJCNCNBNLKMNJN-AATRIKPKSA-N
Formula
C16H8Cl3FO4
SMILES
O=C(C=CC(=O)Oc1c(Cl)cc(Cl)cc1Cl)Oc1ccccc1F
Molecular Weight1
389.59
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
Δfus 48.33 kJ/mol Joback Calculated Property
logPoct/wat 4.853 Crippen Calculated Property
McVol 237.850 ml/mol McGowan Calculated Property
Inp [2548.00; 2548.00]   Show Hide
Inp 2548.00 NIST
Inp 2548.00 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, Ionization energy, 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 [590.27; 624.14] J/mol×K [871.12; 1112.04] Show Hide
Cp,gas 590.27 J/mol×K 871.12 Joback Calculated Property
Cp,gas 598.61 J/mol×K 911.27 Joback Calculated Property
Cp,gas 605.82 J/mol×K 951.43 Joback Calculated Property
Cp,gas 611.94 J/mol×K 991.58 Joback Calculated Property
Cp,gas 617.01 J/mol×K 1031.73 Joback Calculated Property
Cp,gas 621.06 J/mol×K 1071.89 Joback Calculated Property
Cp,gas 624.14 J/mol×K 1112.04 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to Fumaric acid, 2,4,6-trichlorophenyl 2-fluorophenyl 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.