ChemSpider 2D Image | Ethyl 4-(dimethylamino)-η-oxobenzeneoctanoate | C18H27NO3

Ethyl 4-(dimethylamino)-η-oxobenzeneoctanoate

  • Molecular FormulaC18H27NO3
  • Average mass305.412 Da
  • Monoisotopic mass305.199097 Da
  • ChemSpider ID21402410

More details:






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

8-[4-(Diméthylamino)phényl]-8-oxooctanoate d'éthyle [French] [ACD/IUPAC Name]
951886-01-4 [RN]
Benzeneoctanoic acid, 4-(dimethylamino)-η-oxo-, ethyl ester [ACD/Index Name]
Ethyl 4-(dimethylamino)-η-oxobenzeneoctanoate
Ethyl 8-[4-(dimethylamino)phenyl]-8-oxooctanoate [ACD/IUPAC Name]
Ethyl-8-[4-(dimethylamino)phenyl]-8-oxooctanoat [German] [ACD/IUPAC Name]
Ethyl 8-(4-(dimethylamino)phenyl)-8-oxooctanoate
Ethyl 8-[4-(N,N-Dimethylamino)phenyl]-8-oxooctanoate
MFCD09801908 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 433.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.2±24.6 °C
Index of Refraction: 1.519
Molar Refractivity: 89.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 520.35
ACD/KOC (pH 5.5): 3060.90
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 520.67
ACD/KOC (pH 7.4): 3062.79
Polar Surface Area: 47 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 294.5±3.0 cm3

Click to predict properties on the Chemicalize site






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