Chemical Properties of Benzoic acid, 4-ethylamino-, ethyl ester

Benzoic acid, 4-ethylamino-, ethyl ester

InChI
InChI=1S/C11H15NO2/c1-3-12-10-7-5-9(6-8-10)11(13)14-4-2/h5-8,12H,3-4H2,1-2H3
InChI Key
GDIMKVMLVSCQJB-UHFFFAOYSA-N
Formula
C11H15NO2
SMILES
CCNc1ccc(C(=O)OCC)cc1
Molecular Weight1
193.25
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Physical Properties

Property Value Unit Source
ω 0.6317 Relay (1.0) Calculated Property
ΔfH°gas -343.57 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 27.37 kJ/mol Joback Calculated Property
ΔvapH° 79.35 kJ/mol Relay (1.0) Calculated Property
IE 7.57 eV Relay (1.0) Calculated Property
log10WS -3.18 Relay (1.0) Calculated Property
logPoct/wat 2.295 Crippen Calculated Property
McVol 159.510 ml/mol McGowan Calculated Property
Pc 2657.03 kPa Joback Calculated Property
Inp 1772.00 NIST
Tboil 566.23 K Relay (1.0) Calculated Property
Tc 770.98 K Relay (1.0) Calculated Property
Tfus 323.01 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [216.65; 510.26] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.51800e+00
Coefficient B9.31840e-01
Coefficient C-4.92760e-04
Coefficient D7.37000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 216.65 J/mol×K 273.00 Calculated Property
Cp,gas 268.74 J/mol×K 353.78 Calculated Property
Cp,gas 315.41 J/mol×K 434.56 Calculated Property
Cp,gas 356.92 J/mol×K 515.33 Calculated Property
Cp,gas 393.47 J/mol×K 596.11 Calculated Property
Cp,gas 425.32 J/mol×K 676.89 Calculated Property
Cp,gas 452.69 J/mol×K 757.67 Calculated Property
Cp,gas 475.81 J/mol×K 838.44 Calculated Property
Cp,gas 494.93 J/mol×K 919.22 Calculated Property
Cp,gas 510.26 J/mol×K 1000.00 Calculated Property

Similar Compounds

Benzoic acid, 4-(ethylamino)-, methyl ester. Benzoic acid, 4-isopropylamino-, isopropyl ester. ETHYL P-(BUTYLAMINO)BENZOATE. Benzoic acid, 4-propylamino-, propyl ester. Benzoic acid, 4-(propylamino)-, methyl ester. Benzoic acid, 4-(isopropyl)amino-, methyl ester. Benzoic acid, 3-(ethylamino)-, methyl ester. Benzoic acid, p-(2-chloroacetamido)-, ethyl ester. Benzoic acid, p-(2-iodoacetamido)-, ethyl ester. Benzoic acid, 4-diethylamino-, ethyl ester. Propyl p-butylaminobenzoate. Benzoic acid, p-[(3-amino-2-oxopropyl)amino]-, ethyl ester, oxime. Benzoic acid, 2-ethylamino-, ethyl ester. Benzoic acid, 4-(2-methylpropyl)amino-, methyl ester. Benzoic acid, 3-isopropylamino-, isopropyl ester.

Find more compounds similar to Benzoic acid, 4-ethylamino-, ethyl ester.

Sources

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