Chemical Properties of 1-{2-[2-(Diethylamino)ethoxy]phenyl}-3-phenylpropan-1-one

1-{2-[2-(Diethylamino)ethoxy]phenyl}-3-phenylpropan-1-one

InChI
InChI=1S/C21H27NO2/c1-3-22(4-2)16-17-24-21-13-9-8-12-19(21)20(23)15-14-18-10-6-5-7-11-18/h5-13H,3-4,14-17H2,1-2H3
InChI Key
OEGDFSLNGABBKJ-UHFFFAOYSA-N
Formula
C21H27NO2
SMILES
CCN(CC)CCOc1ccccc1C(=O)CCc1ccccc1
Molecular Weight1
325.45
Other Names
  • 1-Propanone, 1-[2-[2-(diethylamino)ethoxy]phenyl]-3-phenyl-
  • 2'-[2-(Diethylamino)ethoxy]-3-phenylpropiophenone
  • LG-11457
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Physical Properties

Property Value Unit Source
ΔfusH° 43.65 kJ/mol Joback Calculated Property
IE 8.05 eV Relay (1.0) Calculated Property
logPoct/wat 4.223 Crippen Calculated Property
McVol 276.650 ml/mol McGowan Calculated Property
Inp [2434.00; 2434.00]   Show Hide
Inp 2434.00 NIST
Inp 2434.00 NIST
Tboil 666.95 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [837.45; 921.66] J/mol×K [826.95; 1042.09] Show Hide
Cp,gas 837.45 J/mol×K 826.95 Joback Calculated Property
Cp,gas 854.35 J/mol×K 862.81 Joback Calculated Property
Cp,gas 870.02 J/mol×K 898.66 Joback Calculated Property
Cp,gas 884.52 J/mol×K 934.52 Joback Calculated Property
Cp,gas 897.91 J/mol×K 970.38 Joback Calculated Property
Cp,gas 910.27 J/mol×K 1006.23 Joback Calculated Property
Cp,gas 921.66 J/mol×K 1042.09 Joback Calculated Property

Similar Compounds

1,2-Diacetoxy-3-[2-(3-phenylpropionyl)phenoxy]propane. Propafenone - H2O, acetylated. Propafenone. PROPAFENONE-H2O, M(DESAMINO-HO-), AC. Propafenone desamino dihydroxy, acetylated. PROPAFENONE-H2O, M(DESAMINO-DI-IIO-), AC. Propafenone hydroxy - H2O, acetylated. PROPAFENONE-H2O, AC. Flavanone. Hesperetin. Glabrol. Lycoramine. Shinflavanone. Griseofulvin. 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dimethoxy-2-phenyl-.

Find more compounds similar to 1-{2-[2-(Diethylamino)ethoxy]phenyl}-3-phenylpropan-1-one.

Sources

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