ChemSpider 2D Image | 2-[({4-[Amino(iminio)methyl]phenyl}amino)methyl]-1-methyl-5-[(2-methyl-1H-benzimidazol-1-yl)methyl]-1H-3,1-benzimidazol-3-ium | C25H27N7

2-[({4-[Amino(iminio)methyl]phenyl}amino)methyl]-1-methyl-5-[(2-methyl-1H-benzimidazol-1-yl)methyl]-1H-3,1-benzimidazol-3-ium

  • Molecular FormulaC25H27N7
  • Average mass425.528 Da
  • Monoisotopic mass425.231689 Da
  • ChemSpider ID21201359

  • Charge - Charge

More details:

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

1H-3,1-Benzimidazolium, 2-[[[4-(aminoiminiomethyl)phenyl]amino]methyl]-1-methyl-5-[(2-methyl-1H-benzimidazol-1-yl)methyl]- [ACD/Index Name]
2-[({4-[Amino(iminio)methyl]phenyl}amino)methyl]-1-methyl-5-[(2-methyl-1H-benzimidazol-1-yl)methyl]-1H-3,1-benzimidazol-3-ium [ACD/IUPAC Name]
2-[({4-[Amino(iminio)methyl]phenyl}amino)methyl]-1-methyl-5-[(2-methyl-1H-benzimidazol-1-yl)methyl]-1H-3,1-benzimidazol-3-ium [German] [ACD/IUPAC Name]
2-[({4-[Amino(iminio)méthyl]phényl}amino)méthyl]-1-méthyl-5-[(2-méthyl-1H-benzimidazol-1-yl)méthyl]-1H-3,1-benzimidazol-3-ium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 738.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.7±3.0 kJ/mol
Flash Point: 400.2±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.96
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 2.70
ACD/KOC (pH 7.4): 18.66
Polar Surface Area: 101 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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