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

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

InChI
InChI=1S/C13H17NO5/c15-8-6-14(7-9-16)12(17)10-19-13(18)11-4-2-1-3-5-11/h1-5,15-16H,6-10H2
InChI Key
UCIUVGVKELKZSD-UHFFFAOYSA-N
Formula
C13H17NO5
SMILES
O=C(OCC(=O)N(CCO)CCO)c1ccccc1
Molecular Weight1
267.28
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Physical Properties

Property Value Unit Source
ω 1.0201 Relay (1.0) Calculated Property
ΔfH°gas -747.42 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 40.63 kJ/mol Joback Calculated Property
ΔvapH° 115.74 kJ/mol Relay (1.0) Calculated Property
IE 8.95 eV Relay (1.0) Calculated Property
log10WS 0.43 Aq. Solubility Prediction
logPoct/wat -0.343 Crippen Calculated Property
McVol 201.000 ml/mol McGowan Calculated Property
Pc 2814.34 kPa Joback Calculated Property
Tboil 648.99 K Relay (1.0) Calculated Property
Tc 907.02 K Relay (1.0) Calculated Property
Tfus 365.37 K Relay (1.0) Calculated Property
Vc 0.711 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 [601.63; 649.28] J/mol×K [832.61; 1027.71] Show Hide
Cp,gas 601.63 J/mol×K 832.61 Joback Calculated Property
Cp,gas 611.36 J/mol×K 865.13 Joback Calculated Property
Cp,gas 620.33 J/mol×K 897.64 Joback Calculated Property
Cp,gas 628.58 J/mol×K 930.16 Joback Calculated Property
Cp,gas 636.13 J/mol×K 962.67 Joback Calculated Property
Cp,gas 643.02 J/mol×K 995.19 Joback Calculated Property
Cp,gas 649.28 J/mol×K 1027.71 Joback Calculated Property

Similar Compounds

[2-(ethyl-(2-hydroxyethyl)amino)-2-oxoethyl] benzoate. [2-(2-hydroxyethyl-methylamino)-2-oxoethyl] benzoate. [2-(bis(2-methoxyethyl)amino)-2-oxoethyl] benzoate. (2-diethylamino-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-(di(prop-2-enyl)amino)-2-oxoethyl] benzoate. (2-oxo-2-pyrrolidin-1-ylethyl) benzoate. [2-(bis(2-methylpropyl)amino)-2-oxoethyl] benzoate. [2-(acetyl-methylamino)-2-oxoethyl] benzoate. [2-(dibutylamino)-2-oxoethyl] benzoate. [2-[(2-ethoxy-2-oxoethyl)-methylamino]-2-oxoethyl] benzoate.

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

Sources

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