ChemSpider 2D Image | 2,6-Dichloro-2,5-cyclohexadien-1-one | C6H4Cl2O

2,6-Dichloro-2,5-cyclohexadien-1-one

  • Molecular FormulaC6H4Cl2O
  • Average mass163.001 Da
  • Monoisotopic mass161.963913 Da
  • ChemSpider ID62895949

More details:






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

2,5-Cyclohexadien-1-one, 2,6-dichloro- [ACD/Index Name]
2,6-Dichlor-2,5-cyclohexadien-1-on [German] [ACD/IUPAC Name]
2,6-Dichloro-2,5-cyclohexadien-1-one [ACD/IUPAC Name]
2,6-Dichloro-2,5-cyclohexadién-1-one [French] [ACD/IUPAC Name]
3225-38-5 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 288.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.7±3.0 kJ/mol
Flash Point: 120.3±27.9 °C
Index of Refraction: 1.550
Molar Refractivity: 36.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 20.71
ACD/KOC (pH 5.5): 304.65
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.71
ACD/KOC (pH 7.4): 304.65
Polar Surface Area: 17 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 40.1±5.0 dyne/cm
Molar Volume: 115.9±5.0 cm3

Click to predict properties on the Chemicalize site






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