ChemSpider 2D Image | 2-Bromo-1-(4-methyl-1,3-thiazol-2-yl)ethanone | C6H6BrNOS

2-Bromo-1-(4-methyl-1,3-thiazol-2-yl)ethanone

  • Molecular FormulaC6H6BrNOS
  • Average mass220.087 Da
  • Monoisotopic mass218.935333 Da
  • ChemSpider ID34444860

More details:

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

2-Brom-1-(4-methyl-1,3-thiazol-2-yl)ethanon [German] [ACD/IUPAC Name]
2-Bromo-1-(4-methyl-1,3-thiazol-2-yl)ethanone [ACD/IUPAC Name]
2-Bromo-1-(4-méthyl-1,3-thiazol-2-yl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-bromo-1-(4-methyl-2-thiazolyl)- [ACD/Index Name]
2-bromo-1-(4-methyl-1,3-thiazol-2-yl)ethan-1-one
2-bromo-1-(4-methylthiazol-2-yl)ethanone
7531-83-1 [RN]
MFCD15526752

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

Density: 1.7±0.1 g/cm3
Boiling Point: 285.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 126.3±27.9 °C
Index of Refraction: 1.596
Molar Refractivity: 45.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.53
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.13
ACD/KOC (pH 5.5): 127.36
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 6.13
ACD/KOC (pH 7.4): 127.36
Polar Surface Area: 58 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 133.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement