ChemSpider 2D Image | 1,1,1,3,3-Pentachloro-3-(2-thienyl)acetone | C7H3Cl5OS

1,1,1,3,3-Pentachloro-3-(2-thienyl)acetone

  • Molecular FormulaC7H3Cl5OS
  • Average mass312.428 Da
  • Monoisotopic mass309.834717 Da
  • ChemSpider ID67033011

More details:

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

1,1,1,3,3-Pentachlor-3-(2-thienyl)aceton [German] [ACD/IUPAC Name]
1,1,1,3,3-Pentachloro-3-(2-thienyl)acetone [ACD/IUPAC Name]
1,1,1,3,3-Pentachloro-3-(2-thiényl)acétone [French] [ACD/IUPAC Name]
2-Propanone, 1,1,1,3,3-pentachloro-3-(2-thienyl)- [ACD/Index Name]
pentachlorothiophenylacetone

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

Density: 1.7±0.1 g/cm3
Boiling Point: 310.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 141.7±26.5 °C
Index of Refraction: 1.600
Molar Refractivity: 62.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 7.78
ACD/LogD (pH 5.5): 5.16
ACD/BCF (pH 5.5): 4945.72
ACD/KOC (pH 5.5): 15343.42
ACD/LogD (pH 7.4): 5.16
ACD/BCF (pH 7.4): 4945.72
ACD/KOC (pH 7.4): 15343.42
Polar Surface Area: 45 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 183.2±3.0 cm3

Click to predict properties on the Chemicalize site


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