ChemSpider 2D Image | 1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(1-oxo-2(1H)-phthalazinyl)-2,5-pyrrolidinedione | C19H11ClF3N3O3

1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(1-oxo-2(1H)-phthalazinyl)-2,5-pyrrolidinedione

  • Molecular FormulaC19H11ClF3N3O3
  • Average mass421.757 Da
  • Monoisotopic mass421.044098 Da
  • ChemSpider ID108295840

More details:

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

1-[4-Chlor-3-(trifluormethyl)phenyl]-3-(1-oxo-2(1H)-phthalazinyl)-2,5-pyrrolidindion [German] [ACD/IUPAC Name]
1-[4-Chloro-3-(trifluorométhyl)phényl]-3-(1-oxo-2(1H)-phtalazinyl)-2,5-pyrrolidinedione [French] [ACD/IUPAC Name]
1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(1-oxo-2(1H)-phthalazinyl)-2,5-pyrrolidinedione [ACD/IUPAC Name]
2,5-Pyrrolidinedione, 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(1-oxo-2(1H)-phthalazinyl)- [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: 660.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 353.0±34.3 °C
Index of Refraction: 1.661
Molar Refractivity: 98.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 58.38
ACD/KOC (pH 5.5): 639.63
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 58.38
ACD/KOC (pH 7.4): 639.63
Polar Surface Area: 70 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 265.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement