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Search term: JELBXPXHOMDHRJ-WSDLNYQXSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-[(E)-{[2-(1H-Benzimidazol-2-yl)phenyl]imino}methyl]-4-bromophenol | C20H14BrN3O

2-[(E)-{[2-(1H-Benzimidazol-2-yl)phenyl]imino}methyl]-4-bromophenol

  • Molecular FormulaC20H14BrN3O
  • Average mass392.249 Da
  • Monoisotopic mass391.032013 Da
  • ChemSpider ID21537650
  • Double-bond stereo - Double-bond stereo


More details:






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

2-[(E)-{[2-(1H-Benzimidazol-2-yl)phenyl]imino}methyl]-4-bromophenol [ACD/IUPAC Name]
2-[(E)-{[2-(1H-Benzimidazol-2-yl)phényl]imino}méthyl]-4-bromophénol [French] [ACD/IUPAC Name]
2-[(E)-{[2-(1H-Benzimidazol-2-yl)phenyl]imino}methyl]-4-bromphenol [German] [ACD/IUPAC Name]
Phenol, 2-[(E)-[[2-(1H-benzimidazol-2-yl)phenyl]imino]methyl]-4-bromo- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 637.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 339.3±34.3 °C
Index of Refraction: 1.699
Molar Refractivity: 102.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.13
ACD/LogD (pH 5.5): 5.43
ACD/BCF (pH 5.5): 7152.87
ACD/KOC (pH 5.5): 17927.16
ACD/LogD (pH 7.4): 5.42
ACD/BCF (pH 7.4): 7081.92
ACD/KOC (pH 7.4): 17749.34
Polar Surface Area: 61 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 53.7±7.0 dyne/cm
Molar Volume: 264.4±7.0 cm3

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