ChemSpider 2D Image | (4-Bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)(3,4-dimethoxyphenyl)methanone | C22H22BrNO6

(4-Bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)(3,4-dimethoxyphenyl)methanone

  • Molecular FormulaC22H22BrNO6
  • Average mass476.317 Da
  • Monoisotopic mass475.063049 Da
  • ChemSpider ID44206948

More details:

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

(4-Brom-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)(3,4-dimethoxyphenyl)methanon [German] [ACD/IUPAC Name]
(4-Bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazepin-8-yl)(3,4-dimethoxyphenyl)methanone [ACD/IUPAC Name]
(4-Bromo-10-méthoxy-7-méthyl-6,7-dihydro-5H-[1,3]dioxolo[4,5-h][3]benzazépin-8-yl)(3,4-diméthoxyphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, (4-bromo-6,7-dihydro-10-methoxy-7-methyl-5H-1,3-dioxolo[4,5-h][3]benzazepin-8-yl)(3,4-dimethoxyphenyl)- [ACD/Index Name]
(4-bromo-10-methoxy-7-methyl-6,7-dihydro-5H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d]azepin-8-yl)(3,4-dimethoxyphenyl)methanone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 629.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 334.8±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 114.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.20
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1120.79
ACD/KOC (pH 5.5): 5299.73
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1122.55
ACD/KOC (pH 7.4): 5308.05
Polar Surface Area: 66 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 332.7±3.0 cm3

Click to predict properties on the Chemicalize site


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