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

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

InChI
InChI=1S/C15H21NO5/c1-19-10-8-16(9-11-20-2)14(17)12-21-15(18)13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3
InChI Key
LJCFRMUKLSCNKV-UHFFFAOYSA-N
Formula
C15H21NO5
SMILES
COCCN(CCOC)C(=O)COC(=O)c1ccccc1
Molecular Weight1
295.33
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Physical Properties

Property Value Unit Source
ω 0.8326 Relay (1.0) Calculated Property
ΔfH°gas -705.64 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 40.01 kJ/mol Joback Calculated Property
ΔvapH° 95.60 kJ/mol Relay (1.0) Calculated Property
IE 8.83 eV Relay (1.0) Calculated Property
log10WS -1.57 Aq. Solubility Prediction
logPoct/wat 0.965 Crippen Calculated Property
McVol 229.180 ml/mol McGowan Calculated Property
Pc 1898.60 kPa Joback Calculated Property
Tboil 627.00 K Relay (1.0) Calculated Property
Tc 831.93 K Relay (1.0) Calculated Property
Tfus 330.65 K Aq. Solubility Prediction
Vc 0.827 m3/kmol Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [330.01; 746.82] 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 A2.84250e+01
Coefficient B1.26464e+00
Coefficient C-6.00700e-04
Coefficient D5.44600e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 330.01 J/mol×K 273.00 Calculated Property
Cp,gas 403.06 J/mol×K 353.78 Calculated Property
Cp,gas 469.02 J/mol×K 434.56 Calculated Property
Cp,gas 528.06 J/mol×K 515.33 Calculated Property
Cp,gas 580.37 J/mol×K 596.11 Calculated Property
Cp,gas 626.11 J/mol×K 676.89 Calculated Property
Cp,gas 665.45 J/mol×K 757.67 Calculated Property
Cp,gas 698.57 J/mol×K 838.44 Calculated Property
Cp,gas 725.64 J/mol×K 919.22 Calculated Property
Cp,gas 746.82 J/mol×K 1000.00 Calculated Property

Similar Compounds

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

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

Sources

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