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

Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-pentyl ester

InChI
InChI=1S/C15H18BrNO3/c1-3-6-11(2)20-15(19)10-9-14(18)17-13-8-5-4-7-12(13)16/h4-5,7-11H,3,6H2,1-2H3,(H,17,18)/b10-9+
InChI Key
YZPLUFJJPUGYDS-MDZDMXLPSA-N
Formula
C15H18BrNO3
SMILES
CCCC(C)OC(=O)C=CC(=O)Nc1ccccc1Br
Molecular Weight1
340.21
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Physical Properties

Property Value Unit Source
ΔfusH° 41.29 kJ/mol Joback Calculated Property
IE 8.60 eV Relay (1.0) Calculated Property
logPoct/wat 3.676 Crippen Calculated Property
McVol 230.640 ml/mol McGowan Calculated Property
Inp [2446.00; 2446.00]   Show Hide
Inp 2446.00 NIST
Inp 2446.00 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 [629.15; 691.31] J/mol×K [806.60; 1030.21] Show Hide
Cp,gas 629.15 J/mol×K 806.60 Joback Calculated Property
Cp,gas 641.81 J/mol×K 843.87 Joback Calculated Property
Cp,gas 653.48 J/mol×K 881.14 Joback Calculated Property
Cp,gas 664.20 J/mol×K 918.40 Joback Calculated Property
Cp,gas 674.03 J/mol×K 955.67 Joback Calculated Property
Cp,gas 683.05 J/mol×K 992.94 Joback Calculated Property
Cp,gas 691.31 J/mol×K 1030.21 Joback Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, isopropyl ester. Griseofulvin. Tetrazepam M (hydroxy-), isomer 2, hydrolysis, acetylated. Uridine, 2',5'-bis-O-acetyl, 3'-O-TBDMS. Uridine, 3'-O-TBDMS.

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

Sources

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