Chemical Properties of [2-(di(prop-2-enyl)amino)-2-oxoethyl] benzoate

[2-(di(prop-2-enyl)amino)-2-oxoethyl] benzoate

InChI
InChI=1S/C15H17NO3/c1-3-10-16(11-4-2)14(17)12-19-15(18)13-8-6-5-7-9-13/h3-9H,1-2,10-12H2
InChI Key
KIBXYDHXHWRNTP-UHFFFAOYSA-N
Formula
C15H17NO3
SMILES
C=CCN(CC=C)C(=O)COC(=O)c1ccccc1
Molecular Weight1
259.31
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Physical Properties

Property Value Unit Source
ω 0.6532 Relay (1.0) Calculated Property
ΔfH°gas -298.47 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 35.08 kJ/mol Joback Calculated Property
ΔvapH° 89.22 kJ/mol Relay (1.0) Calculated Property
IE 8.76 eV Relay (1.0) Calculated Property
log10WS -2.56 Aq. Solubility Prediction
logPoct/wat 2.044 Crippen Calculated Property
McVol 208.840 ml/mol McGowan Calculated Property
Pc 2110.00 kPa Joback Calculated Property
Tboil 620.42 K Relay (1.0) Calculated Property
Tc 813.51 K Relay (1.0) Calculated Property
Tfus 315.65 K Aq. Solubility Prediction
Vc 0.714 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 [554.32; 627.21] J/mol×K [687.37; 894.08] Show Hide
Cp,gas 554.32 J/mol×K 687.37 Joback Calculated Property
Cp,gas 568.90 J/mol×K 721.82 Joback Calculated Property
Cp,gas 582.45 J/mol×K 756.27 Joback Calculated Property
Cp,gas 595.00 J/mol×K 790.73 Joback Calculated Property
Cp,gas 606.62 J/mol×K 825.18 Joback Calculated Property
Cp,gas 617.34 J/mol×K 859.63 Joback Calculated Property
Cp,gas 627.21 J/mol×K 894.08 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to [2-(di(prop-2-enyl)amino)-2-oxoethyl] benzoate.

Sources

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