ChemSpider 2D Image | 1-(2,5-Dibromo-3-thienyl)-2-(2,3-dichlorophenoxy)ethanone | C12H6Br2Cl2O2S

1-(2,5-Dibromo-3-thienyl)-2-(2,3-dichlorophenoxy)ethanone

  • Molecular FormulaC12H6Br2Cl2O2S
  • Average mass444.954 Da
  • Monoisotopic mass441.783203 Da
  • ChemSpider ID37972506

More details:

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

1-(2,5-Dibrom-3-thienyl)-2-(2,3-dichlorphenoxy)ethanon [German] [ACD/IUPAC Name]
1-(2,5-Dibromo-3-thienyl)-2-(2,3-dichlorophenoxy)ethanone [ACD/IUPAC Name]
1-(2,5-Dibromo-3-thiényl)-2-(2,3-dichlorophénoxy)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(2,5-dibromo-3-thienyl)-2-(2,3-dichlorophenoxy)- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 513.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 264.5±30.1 °C
Index of Refraction: 1.653
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.87
ACD/LogD (pH 5.5): 5.63
ACD/BCF (pH 5.5): 11239.65
ACD/KOC (pH 5.5): 27613.27
ACD/LogD (pH 7.4): 5.63
ACD/BCF (pH 7.4): 11239.65
ACD/KOC (pH 7.4): 27613.27
Polar Surface Area: 55 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 235.1±3.0 cm3

Click to predict properties on the Chemicalize site


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