ChemSpider 2D Image | 2-(2-Amino-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-4-yl)-4-bromo-6-iodophenol | C15H11BrIN5O

2-(2-Amino-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-4-yl)-4-bromo-6-iodophenol

  • Molecular FormulaC15H11BrIN5O
  • Average mass484.089 Da
  • Monoisotopic mass482.919159 Da
  • ChemSpider ID68005461

More details:






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

2-(2-Amino-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-4-yl)-4-brom-6-iodphenol [German] [ACD/IUPAC Name]
2-(2-Amino-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-4-yl)-4-bromo-6-iodophenol [ACD/IUPAC Name]
2-(2-Amino-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-4-yl)-4-bromo-6-iodophénol [French] [ACD/IUPAC Name]
Phenol, 2-(2-amino-3,4-dihydro-1,3,5-triazino[1,2-a]benzimidazol-4-yl)-4-bromo-6-iodo- [ACD/Index Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 518.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 267.1±32.9 °C
Index of Refraction: 1.903
Molar Refractivity: 97.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 61.61
ACD/KOC (pH 5.5): 398.50
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 132.43
ACD/KOC (pH 7.4): 856.56
Polar Surface Area: 88 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 80.6±7.0 dyne/cm
Molar Volume: 209.2±7.0 cm3

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