Chemical Properties of [2-(ethyl-(2-hydroxyethyl)amino)-2-oxoethyl] benzoate

[2-(ethyl-(2-hydroxyethyl)amino)-2-oxoethyl] benzoate

InChI
InChI=1S/C13H17NO4/c1-2-14(8-9-15)12(16)10-18-13(17)11-6-4-3-5-7-11/h3-7,15H,2,8-10H2,1H3
InChI Key
IIZIPXWXNPFUOU-UHFFFAOYSA-N
Formula
C13H17NO4
SMILES
CCN(CCO)C(=O)COC(=O)c1ccccc1
Molecular Weight1
251.28
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Physical Properties

Property Value Unit Source
ω 0.8743 Relay (1.0) Calculated Property
ΔfH°gas -619.54 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 36.54 kJ/mol Joback Calculated Property
ΔvapH° 100.19 kJ/mol Relay (1.0) Calculated Property
IE 8.82 eV Relay (1.0) Calculated Property
log10WS -1.37 Aq. Solubility Prediction
logPoct/wat 0.684 Crippen Calculated Property
McVol 195.130 ml/mol McGowan Calculated Property
Pc 2558.51 kPa Joback Calculated Property
Tboil 620.66 K Relay (1.0) Calculated Property
Tc 845.18 K Relay (1.0) Calculated Property
Tfus 340.37 K Relay (1.0) Calculated Property
Vc 0.695 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [551.84; 611.48] J/mol×K [740.43; 935.98] Show Hide
Cp,gas 551.84 J/mol×K 740.43 Joback Calculated Property
Cp,gas 563.78 J/mol×K 773.02 Joback Calculated Property
Cp,gas 574.88 J/mol×K 805.61 Joback Calculated Property
Cp,gas 585.17 J/mol×K 838.20 Joback Calculated Property
Cp,gas 594.68 J/mol×K 870.79 Joback Calculated Property
Cp,gas 603.44 J/mol×K 903.38 Joback Calculated Property
Cp,gas 611.48 J/mol×K 935.98 Joback Calculated Property

Similar Compounds

[2-(bis(2-hydroxyethyl)amino)-2-oxoethyl] benzoate. [2-(2-hydroxyethyl-methylamino)-2-oxoethyl] benzoate. (2-diethylamino-2-oxoethyl) benzoate. [2-(bis(2-methoxyethyl)amino)-2-oxoethyl] benzoate. (2-morpholin-4-yl-2-oxoethyl) benzoate. [2-(bis(2-hydroxypropyl)amino)-2-oxoethyl] benzoate. [2-(dipropylamino)-2-oxoethyl] benzoate. [2-(azetidin-1-yl)-2-oxoethyl] benzoate. [2-(di(propan-2-yl)amino)-2-oxoethyl] benzoate. (2-oxo-2-pyrrolidin-1-ylethyl) benzoate. [2-(di(prop-2-enyl)amino)-2-oxoethyl] benzoate. [2-(acetyl-methylamino)-2-oxoethyl] benzoate. [2-(bis(2-methylpropyl)amino)-2-oxoethyl] benzoate. [2-(dibutylamino)-2-oxoethyl] benzoate. [2-[(2-ethoxy-2-oxoethyl)-methylamino]-2-oxoethyl] benzoate.

Find more compounds similar to [2-(ethyl-(2-hydroxyethyl)amino)-2-oxoethyl] benzoate.

Sources

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