ChemSpider 2D Image | N-(2,4,6-Tribromophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine | C12H13Br3N2

N-(2,4,6-Tribromophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine

  • Molecular FormulaC12H13Br3N2
  • Average mass424.957 Da
  • Monoisotopic mass421.862854 Da
  • ChemSpider ID48474082

More details:

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

2H-Azepin-7-amine, 3,4,5,6-tetrahydro-N-(2,4,6-tribromophenyl)- [ACD/Index Name]
N-(2,4,6-Tribromophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine [ACD/IUPAC Name]
N-(2,4,6-Tribromophényl)-3,4,5,6-tétrahydro-2H-azépin-7-amine [French] [ACD/IUPAC Name]
N-(2,4,6-Tribromphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amin [German] [ACD/IUPAC Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 451.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 226.7±28.7 °C
Index of Refraction: 1.679
Molar Refractivity: 81.5±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 13.74
ACD/KOC (pH 5.5): 63.28
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 116.64
ACD/KOC (pH 7.4): 537.41
Polar Surface Area: 24 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 51.4±7.0 dyne/cm
Molar Volume: 215.9±7.0 cm3

Click to predict properties on the Chemicalize site


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