Chemical Properties of Fumaric acid, 2-nitrophenyl 2-ethylhexyl ester

Fumaric acid, 2-nitrophenyl 2-ethylhexyl ester

InChI
InChI=1S/C18H23NO6/c1-3-5-8-14(4-2)13-24-17(20)11-12-18(21)25-16-10-7-6-9-15(16)19(22)23/h6-7,9-12,14H,3-5,8,13H2,1-2H3/b12-11+
InChI Key
ZKOHDLBDAJJPOZ-VAWYXSNFSA-N
Formula
C18H23NO6
SMILES
CCCCC(CC)COC(=O)C=CC(=O)Oc1ccccc1[N+](=O)[O-]
Molecular Weight1
349.38
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Physical Properties

Property Value Unit Source
ΔfusH° 52.81 kJ/mol Joback Calculated Property
log10WS -5.52 Relay (1.0) Calculated Property
logPoct/wat 3.816 Crippen Calculated Property
McVol 268.720 ml/mol McGowan Calculated Property
Pc 1540.29 kPa Joback Calculated Property
Inp [2562.00; 2562.00]   Show Hide
Inp 2562.00 NIST
Inp 2562.00 NIST
Tboil 628.15 K Relay (1.0) Calculated Property
Tfus 273.98 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 [832.89; 888.23] J/mol×K [915.10; 1139.20] Show Hide
Cp,gas 832.89 J/mol×K 915.10 Joback Calculated Property
Cp,gas 845.08 J/mol×K 952.45 Joback Calculated Property
Cp,gas 856.03 J/mol×K 989.80 Joback Calculated Property
Cp,gas 865.77 J/mol×K 1027.15 Joback Calculated Property
Cp,gas 874.35 J/mol×K 1064.50 Joback Calculated Property
Cp,gas 881.82 J/mol×K 1101.85 Joback Calculated Property
Cp,gas 888.23 J/mol×K 1139.20 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-nitrophenyl cyclohexylmethyl ester. Fumaric acid, 2-nitrophenyl hept-2-yl ester. Fumaric acid, 2-nitrophenyl dec-2-yl ester. Glutaric acid, 2-ethylhexyl 2-nitrophenyl ester. Fumaric acid, 4-nitrophenyl 2-ethylhexyl ester. Glutaric acid, cyclohexylmethyl 2-nitrophenyl ester. Sebacic acid, isohexyl 2-nitrophenyl ester. Glutaric acid, isohexyl 2-nitrophenyl ester. Fumaric acid, isohexyl 3-nitrophenyl ester. Fumaric acid, 2-nitrophenyl 3-methylbut-2-yl ester. Pimelic acid, 4-methyl-2-pentyl 2-nitro-5-fluorophenyl ester. Sebacic acid, isobutyl 2-nitrophenyl ester. Pimelic acid, isobutyl 2-nitrophenyl ester. Fumaric acid, 2-ethylhexyl 2-fluorophenyl ester. Glutaric acid, 2-methylpent-3-yl 2-nitrophenyl ester.

Find more compounds similar to Fumaric acid, 2-nitrophenyl 2-ethylhexyl ester.

Sources

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