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

Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-ethylhexyl ester

InChI
InChI=1S/C20H29NO3/c1-4-7-10-16(5-2)15-24-20(23)14-13-19(22)21-18-12-9-8-11-17(18)6-3/h8-9,11-14,16H,4-7,10,15H2,1-3H3,(H,21,22)/b14-13+
InChI Key
KYBUQKAKXPJJSA-BUHFOSPRSA-N
Formula
C20H29NO3
SMILES
CCCCC(CC)COC(=O)/C=C/C(=O)Nc1ccccc1CC
Molecular Weight1
331.46
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Physical Properties

Property Value Unit Source
ΔfusH° 48.95 kJ/mol Joback Calculated Property
log10WS -5.65 Relay (1.0) Calculated Property
logPoct/wat 4.503 Crippen Calculated Property
McVol 283.590 ml/mol McGowan Calculated Property
Pc 1391.25 kPa Joback Calculated Property
Inp 2725.00 NIST
Tboil 644.39 K Relay (1.0) Calculated Property
Tfus 325.37 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 [875.30; 953.02] J/mol×K [854.84; 1061.61] Show Hide
Cp,gas 875.30 J/mol×K 854.84 Joback Calculated Property
Cp,gas 890.85 J/mol×K 889.30 Joback Calculated Property
Cp,gas 905.29 J/mol×K 923.76 Joback Calculated Property
Cp,gas 918.67 J/mol×K 958.23 Joback Calculated Property
Cp,gas 931.05 J/mol×K 992.69 Joback Calculated Property
Cp,gas 942.48 J/mol×K 1027.15 Joback Calculated Property
Cp,gas 953.02 J/mol×K 1061.61 Joback Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-pentyl ester. Oxymorphone, bis(trimethylsilyl) ether. cis-1,2-Tetralinediol, ferrocenylboronate. Naloxone, bis(trimethylsilyl) ether. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5«alpha»)-. Hydrastine. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Naloxone. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. risperidone. Noscapine. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. Oxycodone. Oxycodone, trimethylsilyl ether. Oxycodone tms derivative.

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

Sources

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