ChemSpider 2D Image | 2,6-Dichloro-2,4,6-cycloheptatrien-1-one | C7H4Cl2O

2,6-Dichloro-2,4,6-cycloheptatrien-1-one

  • Molecular FormulaC7H4Cl2O
  • Average mass175.012 Da
  • Monoisotopic mass173.963913 Da
  • ChemSpider ID60825330

More details:

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

2,4,6-Cycloheptatrien-1-one, 2,6-dichloro- [ACD/Index Name]
2,6-Dichlor-2,4,6-cycloheptatrien-1-on [German] [ACD/IUPAC Name]
2,6-Dichloro-2,4,6-cycloheptatrien-1-one [ACD/IUPAC Name]
2,6-Dichloro-2,4,6-cycloheptatrién-1-one [French] [ACD/IUPAC Name]
1822999-91-6 [RN]
MFCD24703153

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

Density: 1.4±0.1 g/cm3
Boiling Point: 232.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.9±3.0 kJ/mol
Flash Point: 94.1±27.9 °C
Index of Refraction: 1.574
Molar Refractivity: 41.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.04
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 8.58
ACD/KOC (pH 5.5): 162.07
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 8.58
ACD/KOC (pH 7.4): 162.07
Polar Surface Area: 17 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 41.5±5.0 dyne/cm
Molar Volume: 125.7±5.0 cm3

Click to predict properties on the Chemicalize site


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