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

(2-methylamino-2-oxoethyl) benzoate

InChI
InChI=1S/C10H11NO3/c1-11-9(12)7-14-10(13)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,12)
InChI Key
ZWAHHEQQTJUTPW-UHFFFAOYSA-N
Formula
C10H11NO3
SMILES
CNC(=O)COC(=O)c1ccccc1
Molecular Weight1
193.20
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Physical Properties

Property Value Unit Source
ω 0.6322 Relay (1.0) Calculated Property
Δfgas -415.67 kJ/mol Relay (1.0) Calculated Property
Δfus 26.76 kJ/mol Joback Calculated Property
Δvap 84.70 kJ/mol Relay (1.0) Calculated Property
IE 9.06 eV Relay (1.0) Calculated Property
log10WS -1.72 Aq. Solubility Prediction
logPoct/wat 0.589 Crippen Calculated Property
McVol 146.990 ml/mol McGowan Calculated Property
Pc 3206.41 kPa Joback Calculated Property
Tboil 562.97 K Relay (1.0) Calculated Property
Tc 794.08 K Relay (1.0) Calculated Property
Tfus 384.65 K Aq. Solubility Prediction
Vc 0.533 m3/kmol Relay (1.0) Calculated Property

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [360.29; 422.41] J/mol×K [617.34; 835.16] Show Hide
Cp,gas 360.29 J/mol×K 617.34 Joback Calculated Property
Cp,gas 372.77 J/mol×K 653.64 Joback Calculated Property
Cp,gas 384.37 J/mol×K 689.95 Joback Calculated Property
Cp,gas 395.11 J/mol×K 726.25 Joback Calculated Property
Cp,gas 405.02 J/mol×K 762.55 Joback Calculated Property
Cp,gas 414.11 J/mol×K 798.86 Joback Calculated Property
Cp,gas 422.41 J/mol×K 835.16 Joback Calculated Property

Similar Compounds

(2-ethylamino-2-oxoethyl) benzoate. (2-dimethylamino-2-oxoethyl) benzoate. (2-acetamido-2-oxoethyl) benzoate. (2-amino-2-oxoethyl) benzoate. [2-(tert-butylamino)-2-oxoethyl] benzoate. [2-oxo-2-(propan-2-ylamino)ethyl] benzoate. [2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] benzoate. [2-(acetyl-methylamino)-2-oxoethyl] benzoate. (2-oxo-2-propylaminoethyl) benzoate. (2-diethylamino-2-oxoethyl) benzoate. [2-(2-hydroxyethyl-methylamino)-2-oxoethyl] benzoate. 2-(Benzoyloxy)-N-butylacetamide. [2-(bis(2-hydroxyethyl)amino)-2-oxoethyl] benzoate. [2-(ethyl-(2-hydroxyethyl)amino)-2-oxoethyl] benzoate. [2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]-2-oxoethyl] benzoate.

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

Sources

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