ChemSpider 2D Image | 1-[3-(1H-Benzimidazol-2-yl)propyl]-3-[(2,5-dichlorophenyl)amino]-4-(2-nitrophenyl)-1H-pyrrole-2,5-dione | C26H19Cl2N5O4

1-[3-(1H-Benzimidazol-2-yl)propyl]-3-[(2,5-dichlorophenyl)amino]-4-(2-nitrophenyl)-1H-pyrrole-2,5-dione

  • Molecular FormulaC26H19Cl2N5O4
  • Average mass536.366 Da
  • Monoisotopic mass535.081421 Da
  • ChemSpider ID127338325

More details:

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

1-[3-(1H-Benzimidazol-2-yl)propyl]-3-[(2,5-dichlorophenyl)amino]-4-(2-nitrophenyl)-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
1-[3-(1H-Benzimidazol-2-yl)propyl]-3-[(2,5-dichlorophényl)amino]-4-(2-nitrophényl)-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
1-[3-(1H-Benzimidazol-2-yl)propyl]-3-[(2,5-dichlorphenyl)amino]-4-(2-nitrophenyl)-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]
1H-Pyrrole-2,5-dione, 1-[3-(1H-benzimidazol-2-yl)propyl]-3-[(2,5-dichlorophenyl)amino]-4-(2-nitrophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 773.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.5±3.0 kJ/mol
Flash Point: 421.4±32.9 °C
Index of Refraction: 1.744
Molar Refractivity: 140.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 996.38
ACD/KOC (pH 5.5): 3308.48
ACD/LogD (pH 7.4): 5.01
ACD/BCF (pH 7.4): 3755.17
ACD/KOC (pH 7.4): 12468.99
Polar Surface Area: 124 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 80.5±3.0 dyne/cm
Molar Volume: 347.4±3.0 cm3

Click to predict properties on the Chemicalize site


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