ChemSpider 2D Image | 4,4'-(1H,1'H-5,5'-Bibenzimidazole-2,2'-diyl)diphenol | C26H18N4O2

4,4'-(1H,1'H-5,5'-Bibenzimidazole-2,2'-diyl)diphenol

  • Molecular FormulaC26H18N4O2
  • Average mass418.447 Da
  • Monoisotopic mass418.142975 Da
  • ChemSpider ID21252442

More details:

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

4,4'-(1H,1'H-5,5'-Bibenzimidazol-2,2'-diyl)diphenol [German] [ACD/IUPAC Name]
4,4'-(1H,1'H-5,5'-Bibenzimidazole-2,2'-diyl)diphenol [ACD/IUPAC Name]
4,4'-(1H,1'H-5,5'-Bibenzimidazole-2,2'-diyl)diphénol [French] [ACD/IUPAC Name]
4-{[4-HYDROXY-PHENYL]-1H-BENZIMIDAZOLE-5-YL}-BENZIMIDAZOLE-2-YL-[4-HYDROXY-BENZENE]
Phenol, 4,4'-[5,5'-bi-1H-benzimidazole]-2,2'-diylbis- [ACD/Index Name]
4-[2'-(4-hydroxyphenyl)-3H,3'H-5,5'-bibenzimidazol-2-yl]phenol
E96

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

Density: 1.4±0.1 g/cm3
Boiling Point: 807.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 121.5±3.0 kJ/mol
Flash Point: 442.2±37.1 °C
Index of Refraction: 1.792
Molar Refractivity: 124.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.30
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 828.36
ACD/KOC (pH 5.5): 3649.74
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1378.32
ACD/KOC (pH 7.4): 6072.88
Polar Surface Area: 98 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 78.1±3.0 dyne/cm
Molar Volume: 293.5±3.0 cm3

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