ChemSpider 2D Image | (4,5,6,7-Tetrabromo-1H-benzimidazol-1-yl)acetic acid | C9H4Br4N2O2

(4,5,6,7-Tetrabromo-1H-benzimidazol-1-yl)acetic acid

  • Molecular FormulaC9H4Br4N2O2
  • Average mass491.756 Da
  • Monoisotopic mass487.700592 Da
  • ChemSpider ID24649156

More details:






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

(4,5,6,7-Tetrabrom-1H-benzimidazol-1-yl)essigsäure [German] [ACD/IUPAC Name]
(4,5,6,7-Tetrabromo-1H-benzimidazol-1-yl)acetic acid [ACD/IUPAC Name]
1H-Benzimidazole-1-acetic acid, 4,5,6,7-tetrabromo- [ACD/Index Name]
Acide (4,5,6,7-tétrabromo-1H-benzimidazol-1-yl)acétique [French] [ACD/IUPAC Name]
brominated benzimidazole, 20
K68

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.7±0.1 g/cm3
Boiling Point: 587.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.3±3.0 kJ/mol
Flash Point: 309.2±32.9 °C
Index of Refraction: 1.808
Molar Refractivity: 77.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 2.39
ACD/BCF (pH 5.5): 14.30
ACD/KOC (pH 5.5): 71.47
ACD/LogD (pH 7.4): 0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.72
Polar Surface Area: 55 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 74.7±7.0 dyne/cm
Molar Volume: 180.8±7.0 cm3

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