ChemSpider 2D Image | 3,4,5-Trichloro-2,4,6-cycloheptatrien-1-one | C7H3Cl3O

3,4,5-Trichloro-2,4,6-cycloheptatrien-1-one

  • Molecular FormulaC7H3Cl3O
  • Average mass209.457 Da
  • Monoisotopic mass207.924942 Da
  • ChemSpider ID74845958

More details:

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

2,4,6-Cycloheptatrien-1-one, 3,4,5-trichloro- [ACD/Index Name]
3,4,5-Trichlor-2,4,6-cycloheptatrien-1-on [German] [ACD/IUPAC Name]
3,4,5-Trichloro-2,4,6-cycloheptatrien-1-one [ACD/IUPAC Name]
3,4,5-Trichloro-2,4,6-cycloheptatrién-1-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 205.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.1±3.0 kJ/mol
Flash Point: 80.8±27.9 °C
Index of Refraction: 1.586
Molar Refractivity: 46.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 24.95
ACD/KOC (pH 5.5): 348.04
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 24.95
ACD/KOC (pH 7.4): 348.04
Polar Surface Area: 17 Å2
Polarizability: 18.3±0.5 10-24cm3
Surface Tension: 44.4±5.0 dyne/cm
Molar Volume: 137.2±5.0 cm3

Click to predict properties on the Chemicalize site


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