ChemSpider 2D Image | 7-Chloro-3-[3-(2,5-dichlorophenoxy)-2-hydroxypropyl]-6-nitro-4(3H)-quinazolinone | C17H12Cl3N3O5

7-Chloro-3-[3-(2,5-dichlorophenoxy)-2-hydroxypropyl]-6-nitro-4(3H)-quinazolinone

  • Molecular FormulaC17H12Cl3N3O5
  • Average mass444.653 Da
  • Monoisotopic mass442.984253 Da
  • ChemSpider ID21942682

More details:

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

4(3H)-Quinazolinone, 7-chloro-3-[3-(2,5-dichlorophenoxy)-2-hydroxypropyl]-6-nitro- [ACD/Index Name]
7-Chlor-3-[3-(2,5-dichlorphenoxy)-2-hydroxypropyl]-6-nitro-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
7-Chloro-3-[3-(2,5-dichlorophenoxy)-2-hydroxypropyl]-6-nitro-4(3H)-quinazolinone [ACD/IUPAC Name]
7-Chloro-3-[3-(2,5-dichlorophénoxy)-2-hydroxypropyl]-6-nitro-4(3H)-quinazolinone [French] [ACD/IUPAC 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: 665.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.9±3.0 kJ/mol
Flash Point: 356.5±34.3 °C
Index of Refraction: 1.685
Molar Refractivity: 102.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 486.56
ACD/KOC (pH 5.5): 2917.79
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 486.56
ACD/KOC (pH 7.4): 2917.79
Polar Surface Area: 108 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 63.3±7.0 dyne/cm
Molar Volume: 270.5±7.0 cm3

Click to predict properties on the Chemicalize site


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