ChemSpider 2D Image | 6-Bromo-9-chloro-2-methyl-4H-[1]benzothieno[3,2-d][1,3]oxazin-4-one | C11H5BrClNO2S

6-Bromo-9-chloro-2-methyl-4H-[1]benzothieno[3,2-d][1,3]oxazin-4-one

  • Molecular FormulaC11H5BrClNO2S
  • Average mass330.585 Da
  • Monoisotopic mass328.891266 Da
  • ChemSpider ID24808446

More details:

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

4H-[1]Benzothieno[3,2-d][1,3]oxazin-4-one, 6-bromo-9-chloro-2-methyl- [ACD/Index Name]
6-Brom-9-chlor-2-methyl-4H-[1]benzothieno[3,2-d][1,3]oxazin-4-on [German] [ACD/IUPAC Name]
6-Bromo-9-chloro-2-methyl-4H-[1]benzothieno[3,2-d][1,3]oxazin-4-one [ACD/IUPAC Name]
6-Bromo-9-chloro-2-méthyl-4H-[1]benzothiéno[3,2-d][1,3]oxazin-4-one [French] [ACD/IUPAC Name]
Kinome_3260

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

Density: 2.0±0.1 g/cm3
Boiling Point: 472.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.6±3.0 kJ/mol
Flash Point: 239.7±31.5 °C
Index of Refraction: 1.782
Molar Refractivity: 70.7±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1047.31
ACD/KOC (pH 5.5): 5050.91
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1047.31
ACD/KOC (pH 7.4): 5050.91
Polar Surface Area: 67 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 62.9±7.0 dyne/cm
Molar Volume: 168.2±7.0 cm3

Click to predict properties on the Chemicalize site


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