ChemSpider 2D Image | 2-Chloro-4,4-difluoro-2,5-cyclohexadien-1-one | C6H3ClF2O

2-Chloro-4,4-difluoro-2,5-cyclohexadien-1-one

  • Molecular FormulaC6H3ClF2O
  • Average mass164.537 Da
  • Monoisotopic mass163.984055 Da
  • ChemSpider ID60824081

More details:

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

2,5-Cyclohexadien-1-one, 2-chloro-4,4-difluoro- [ACD/Index Name]
2-Chlor-4,4-difluor-2,5-cyclohexadien-1-on [German] [ACD/IUPAC Name]
2-Chloro-4,4-difluoro-2,5-cyclohexadien-1-one [ACD/IUPAC Name]
2-Chloro-4,4-difluoro-2,5-cyclohexadién-1-one [French] [ACD/IUPAC Name]
105277-17-6 [RN]
MFCD24696909

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

Density: 1.4±0.1 g/cm3
Boiling Point: 199.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.5±3.0 kJ/mol
Flash Point: 74.2±27.3 °C
Index of Refraction: 1.476
Molar Refractivity: 32.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.36
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 8.48
ACD/KOC (pH 5.5): 160.75
ACD/LogD (pH 7.4): 1.52
ACD/BCF (pH 7.4): 8.48
ACD/KOC (pH 7.4): 160.75
Polar Surface Area: 17 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 30.3±5.0 dyne/cm
Molar Volume: 115.4±5.0 cm3

Click to predict properties on the Chemicalize site


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