Chemical Properties of (2-dimethylamino-2-oxoethyl) benzoate

(2-dimethylamino-2-oxoethyl) benzoate

InChI
InChI=1S/C11H13NO3/c1-12(2)10(13)8-15-11(14)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChI Key
WKIMLEWQZUKSJM-UHFFFAOYSA-N
Formula
C11H13NO3
SMILES
CN(C)C(=O)COC(=O)c1ccccc1
Molecular Weight1
207.23
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Physical Properties

Property Value Unit Source
ω 0.6160 Relay (1.0) Calculated Property
ΔfH°gas -401.66 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 27.28 kJ/mol Joback Calculated Property
ΔvapH° 86.27 kJ/mol Relay (1.0) Calculated Property
IE 8.78 eV Relay (1.0) Calculated Property
log10WS -1.37 Aq. Solubility Prediction
logPoct/wat 0.932 Crippen Calculated Property
McVol 161.080 ml/mol McGowan Calculated Property
Pc 2838.39 kPa Joback Calculated Property
Tboil 566.52 K Relay (1.0) Calculated Property
Tc 776.50 K Relay (1.0) Calculated Property
Tfus 354.65 K Aq. Solubility Prediction
Vc 0.604 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 [396.02; 465.96] J/mol×K [602.49; 814.15] Show Hide
Cp,gas 396.02 J/mol×K 602.49 Joback Calculated Property
Cp,gas 409.96 J/mol×K 637.77 Joback Calculated Property
Cp,gas 422.94 J/mol×K 673.04 Joback Calculated Property
Cp,gas 435.00 J/mol×K 708.32 Joback Calculated Property
Cp,gas 446.17 J/mol×K 743.60 Joback Calculated Property
Cp,gas 456.48 J/mol×K 778.87 Joback Calculated Property
Cp,gas 465.96 J/mol×K 814.15 Joback Calculated Property

Similar Compounds

[2-(acetyl-methylamino)-2-oxoethyl] benzoate. (2-methylamino-2-oxoethyl) benzoate. (2-diethylamino-2-oxoethyl) benzoate. [2-(2-hydroxyethyl-methylamino)-2-oxoethyl] benzoate. [2-[(2-amino-2-oxoethyl)-methylamino]-2-oxoethyl] benzoate. [2-(bis(2-hydroxyethyl)amino)-2-oxoethyl] benzoate. [2-(ethyl-(2-hydroxyethyl)amino)-2-oxoethyl] benzoate. Benzoic acid, 2-(dimethylamino)ethyl ester. [2-(di(propan-2-yl)amino)-2-oxoethyl] benzoate. [2-(azetidin-1-yl)-2-oxoethyl] benzoate. (2-amino-2-oxoethyl) benzoate. (2-ethylamino-2-oxoethyl) benzoate. [2-(di(prop-2-enyl)amino)-2-oxoethyl] benzoate. [2-(bis(2-methoxyethyl)amino)-2-oxoethyl] benzoate. (2-morpholin-4-yl-2-oxoethyl) benzoate.

Find more compounds similar to (2-dimethylamino-2-oxoethyl) benzoate.

Sources

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