ChemSpider 2D Image | 2-(3-Bromopropyl)-6-(1-piperidinyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione | C20H21BrN2O2

2-(3-Bromopropyl)-6-(1-piperidinyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione

  • Molecular FormulaC20H21BrN2O2
  • Average mass401.297 Da
  • Monoisotopic mass400.078644 Da
  • ChemSpider ID30654116

More details:

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

1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-(3-bromopropyl)-6-(1-piperidinyl)- [ACD/Index Name]
2-(3-Bromopropyl)-6-(1-pipéridinyl)-1H-benzo[de]isoquinoléine-1,3(2H)-dione [French] [ACD/IUPAC Name]
2-(3-Bromopropyl)-6-(1-piperidinyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione [ACD/IUPAC Name]
2-(3-Brompropyl)-6-(1-piperidinyl)-1H-benzo[de]isochinolin-1,3(2H)-dion [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 577.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 303.0±25.9 °C
Index of Refraction: 1.660
Molar Refractivity: 102.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 273.11
ACD/KOC (pH 5.5): 1924.40
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 275.85
ACD/KOC (pH 7.4): 1943.65
Polar Surface Area: 41 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 276.2±3.0 cm3

Click to predict properties on the Chemicalize site


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