ChemSpider 2D Image | 1-(2,5-Dichlorophenyl)-3-[(2,3-dichlorophenyl)amino]-4-[(2-furylmethyl)sulfanyl]-1H-pyrrole-2,5-dione | C21H12Cl4N2O3S

1-(2,5-Dichlorophenyl)-3-[(2,3-dichlorophenyl)amino]-4-[(2-furylmethyl)sulfanyl]-1H-pyrrole-2,5-dione

  • Molecular FormulaC21H12Cl4N2O3S
  • Average mass514.209 Da
  • Monoisotopic mass511.932281 Da
  • ChemSpider ID60103559

More details:

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

1-(2,5-Dichlorophenyl)-3-[(2,3-dichlorophenyl)amino]-4-[(2-furylmethyl)sulfanyl]-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
1-(2,5-Dichlorophényl)-3-[(2,3-dichlorophényl)amino]-4-[(2-furylméthyl)sulfanyl]-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
1-(2,5-Dichlorphenyl)-3-[(2,3-dichlorphenyl)amino]-4-[(2-furylmethyl)sulfanyl]-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]
1H-Pyrrole-2,5-dione, 1-(2,5-dichlorophenyl)-3-[(2,3-dichlorophenyl)amino]-4-[(2-furanylmethyl)thio]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 601.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 317.3±31.5 °C
Index of Refraction: 1.725
Molar Refractivity: 124.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 6.04
ACD/BCF (pH 5.5): 22862.37
ACD/KOC (pH 5.5): 45903.39
ACD/LogD (pH 7.4): 6.04
ACD/BCF (pH 7.4): 22862.37
ACD/KOC (pH 7.4): 45903.39
Polar Surface Area: 88 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 313.2±5.0 cm3

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