ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-{[6-(2-methyl-2-propanyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]methyl}benzamide | C30H34N2O5

N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-{[6-(2-methyl-2-propanyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]methyl}benzamide

  • Molecular FormulaC30H34N2O5
  • Average mass502.601 Da
  • Monoisotopic mass502.246765 Da
  • ChemSpider ID4230857

More details:

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

Benzamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[6-(1,1-dimethylethyl)-2,3-dihydro-3-oxo-4H-1,4-benzoxazin-4-yl]methyl]- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-{[6-(2-methyl-2-propanyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]methyl}benzamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-{[6-(2-methyl-2-propanyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]methyl}benzamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-3-{[6-(2-méthyl-2-propanyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]méthyl}benzamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 732.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 396.8±32.9 °C
Index of Refraction: 1.586
Molar Refractivity: 142.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 2568.93
ACD/KOC (pH 5.5): 9600.36
ACD/LogD (pH 7.4): 4.79
ACD/BCF (pH 7.4): 2569.10
ACD/KOC (pH 7.4): 9601.00
Polar Surface Area: 77 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 425.4±3.0 cm3

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