Chemical Properties of Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-ethylhexyl ester

Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-ethylhexyl ester

InChI
InChI=1S/C18H24ClNO3/c1-3-5-6-14(4-2)13-23-18(22)12-11-17(21)20-16-9-7-15(19)8-10-16/h7-12,14H,3-6,13H2,1-2H3,(H,20,21)/b12-11+
InChI Key
MYIGZTONFLPUEF-VAWYXSNFSA-N
Formula
C18H24ClNO3
SMILES
CCCCC(CC)COC(=O)C=CC(=O)Nc1ccc(Cl)cc1
Molecular Weight1
337.84
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° 47.97 kJ/mol Joback Calculated Property
log10WS -5.75 Relay (1.0) Calculated Property
logPoct/wat 4.594 Crippen Calculated Property
McVol 267.650 ml/mol McGowan Calculated Property
Pc 1567.23 kPa Joback Calculated Property
Inp [2896.00; 2896.00]   Show Hide
Inp 2896.00 NIST
Inp 2896.00 NIST
Tboil 647.59 K Relay (1.0) Calculated Property
Tfus 330.46 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [785.35; 854.32] J/mol×K [846.51; 1058.30] Show Hide
Cp,gas 785.35 J/mol×K 846.51 Joback Calculated Property
Cp,gas 799.30 J/mol×K 881.81 Joback Calculated Property
Cp,gas 812.20 J/mol×K 917.11 Joback Calculated Property
Cp,gas 824.09 J/mol×K 952.40 Joback Calculated Property
Cp,gas 835.04 J/mol×K 987.70 Joback Calculated Property
Cp,gas 845.10 J/mol×K 1023.00 Joback Calculated Property
Cp,gas 854.32 J/mol×K 1058.30 Joback Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-pentyl ester. O,O,O-Tris(tert-butyldimethylsilyl)uridine. 2',3'-Bis-(trimethylsiloxy)-5'-(tert-butyldimethylsiloxy)-uridine. Uridine, 2',5'-bis-O-TBDMS, 3'-O-TMS. Uridine, 3',5'-bis-O-TBDMS. Uridine, 2',3'-bis-O-TBDMS, 5'-O-TMS. Uridine, 2',3'-bis-O-TBDMS. 2',5'-Bis-(trimethylsiloxy)-3'-(tert-butyldimethylsiloxy)-uridine.

Find more compounds similar to Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-ethylhexyl 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.