ChemSpider 2D Image | 1-(4-Bromophenyl)-2-(2-thioxo-1(2H)-pyridinyl)ethanone | C13H10BrNOS

1-(4-Bromophenyl)-2-(2-thioxo-1(2H)-pyridinyl)ethanone

  • Molecular FormulaC13H10BrNOS
  • Average mass308.194 Da
  • Monoisotopic mass306.966644 Da
  • ChemSpider ID57436605

More details:

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

1-(4-Bromophenyl)-2-(2-thioxo-1(2H)-pyridinyl)ethanone [ACD/IUPAC Name]
1-(4-Bromophényl)-2-(2-thioxo-1(2H)-pyridinyl)éthanone [French] [ACD/IUPAC Name]
1-(4-Bromphenyl)-2-(2-thioxo-1(2H)-pyridinyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-(4-bromophenyl)-2-(2-thioxo-1(2H)-pyridinyl)- [ACD/Index Name]
1-(4-Bromophenyl)-2-(2-thioxopyridin-1(2H)-yl)ethanone
13134-71-9 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 447.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 224.3±31.5 °C
Index of Refraction: 1.706
Molar Refractivity: 75.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 45.56
ACD/KOC (pH 5.5): 535.59
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 45.56
ACD/KOC (pH 7.4): 535.59
Polar Surface Area: 52 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 67.9±5.0 dyne/cm
Molar Volume: 194.7±5.0 cm3

Click to predict properties on the Chemicalize site


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