ChemSpider 2D Image | 3-(4-Bromophenyl)-4-[(3,4-dichlorophenyl)amino]-1-[2-(diethylamino)ethyl]-1H-pyrrole-2,5-dione | C22H22BrCl2N3O2

3-(4-Bromophenyl)-4-[(3,4-dichlorophenyl)amino]-1-[2-(diethylamino)ethyl]-1H-pyrrole-2,5-dione

  • Molecular FormulaC22H22BrCl2N3O2
  • Average mass511.239 Da
  • Monoisotopic mass509.027252 Da
  • ChemSpider ID118964419

More details:

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

1H-Pyrrole-2,5-dione, 3-(4-bromophenyl)-4-[(3,4-dichlorophenyl)amino]-1-[2-(diethylamino)ethyl]- [ACD/Index Name]
3-(4-Bromophenyl)-4-[(3,4-dichlorophenyl)amino]-1-[2-(diethylamino)ethyl]-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
3-(4-Bromophényl)-4-[(3,4-dichlorophényl)amino]-1-[2-(diéthylamino)éthyl]-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
3-(4-Bromphenyl)-4-[(3,4-dichlorphenyl)amino]-1-[2-(diethylamino)ethyl]-1H-pyrrol-2,5-dion [German] [ACD/IUPAC 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: 581.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 305.4±30.1 °C
Index of Refraction: 1.649
Molar Refractivity: 124.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 4.99
ACD/KOC (pH 5.5): 14.74
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 30.69
ACD/KOC (pH 7.4): 90.70
Polar Surface Area: 53 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 342.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement