ChemSpider 2D Image | 8-Chloro-3-methyl-4H-chromeno[3,4-d][1,2]oxazol-4-one | C11H6ClNO3

8-Chloro-3-methyl-4H-chromeno[3,4-d][1,2]oxazol-4-one

  • Molecular FormulaC11H6ClNO3
  • Average mass235.623 Da
  • Monoisotopic mass235.003616 Da
  • ChemSpider ID21410796

More details:

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

4H-[1]Benzopyrano[3,4-d]isoxazol-4-one, 8-chloro-3-methyl- [ACD/Index Name]
8-Chlor-3-methyl-4H-chromeno[3,4-d][1,2]oxazol-4-on [German] [ACD/IUPAC Name]
8-Chloro-3-methyl-4H-chromeno[3,4-d][1,2]oxazol-4-one [ACD/IUPAC Name]
8-Chloro-3-méthyl-4H-chroméno[3,4-d][1,2]oxazol-4-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 442.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.0±3.0 kJ/mol
Flash Point: 221.4±27.3 °C
Index of Refraction: 1.623
Molar Refractivity: 55.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 80.80
ACD/KOC (pH 5.5): 807.09
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 80.80
ACD/KOC (pH 7.4): 807.09
Polar Surface Area: 52 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 157.9±3.0 cm3

Click to predict properties on the Chemicalize site


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