ChemSpider 2D Image | 1-(5-Bromo-1,2,3-thiadiazol-4-yl)ethanone | C4H3BrN2OS

1-(5-Bromo-1,2,3-thiadiazol-4-yl)ethanone

  • Molecular FormulaC4H3BrN2OS
  • Average mass207.048 Da
  • Monoisotopic mass205.914932 Da
  • ChemSpider ID45561764

More details:

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

1-(5-Brom-1,2,3-thiadiazol-4-yl)ethanon [German] [ACD/IUPAC Name]
1-(5-Bromo-1,2,3-thiadiazol-4-yl)ethanone [ACD/IUPAC Name]
1-(5-Bromo-1,2,3-thiadiazol-4-yl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(5-bromo-1,2,3-thiadiazol-4-yl)- [ACD/Index Name]
1783767-71-4 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 296.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.6±3.0 kJ/mol
Flash Point: 132.9±30.1 °C
Index of Refraction: 1.597
Molar Refractivity: 38.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.85
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.26
ACD/KOC (pH 5.5): 98.28
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.26
ACD/KOC (pH 7.4): 98.28
Polar Surface Area: 71 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 113.1±3.0 cm3

Click to predict properties on the Chemicalize site


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