ChemSpider 2D Image | Ethyl 7-[4-(dimethylamino)phenyl]-7-oxoheptanoate | C17H25NO3

Ethyl 7-[4-(dimethylamino)phenyl]-7-oxoheptanoate

  • Molecular FormulaC17H25NO3
  • Average mass291.385 Da
  • Monoisotopic mass291.183441 Da
  • ChemSpider ID21402409

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

7-[4-(Diméthylamino)phényl]-7-oxoheptanoate d'éthyle [French] [ACD/IUPAC Name]
91727-04-7 [RN]
Benzeneheptanoic acid, 4-(dimethylamino)-ζ-oxo-, ethyl ester [ACD/Index Name]
Ethyl 7-[4-(dimethylamino)phenyl]-7-oxoheptanoate [ACD/IUPAC Name]
Ethyl 7-[4-(N,N-Dimethylamino)phenyl]-7-oxoheptanoate
Ethyl-7-[4-(dimethylamino)phenyl]-7-oxoheptanoat [German] [ACD/IUPAC Name]
Ethyl7-[4-(N,N-Dimethylamino)phenyl]-7-oxoheptanoate
MFCD09801907 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 420.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 208.4±24.6 °C
Index of Refraction: 1.522
Molar Refractivity: 84.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 258.21
ACD/KOC (pH 5.5): 1853.64
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 258.37
ACD/KOC (pH 7.4): 1854.76
Polar Surface Area: 47 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 278.0±3.0 cm3

Click to predict properties on the Chemicalize site


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