ChemSpider 2D Image | 3-(4-Chlorophenyl)-2,1-benzoxazole-5-carbonyl chloride | C14H7Cl2NO2

3-(4-Chlorophenyl)-2,1-benzoxazole-5-carbonyl chloride

  • Molecular FormulaC14H7Cl2NO2
  • Average mass292.117 Da
  • Monoisotopic mass290.985382 Da
  • ChemSpider ID24741189

More details:

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

2,1-Benzisoxazole-5-carbonyl chloride, 3-(4-chlorophenyl)- [ACD/Index Name]
3-(4-Chlorophenyl)-2,1-benzoxazole-5-carbonyl chloride [ACD/IUPAC Name]
3-(4-Chlorphenyl)-2,1-benzoxazol-5-carbonylchlorid [German] [ACD/IUPAC Name]
Chlorure de 3-(4-chlorophényl)-2,1-benzoxazole-5-carbonyle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 458.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.9±3.0 kJ/mol
Flash Point: 231.1±24.6 °C
Index of Refraction: 1.651
Molar Refractivity: 74.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 470.42
ACD/KOC (pH 5.5): 2848.21
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 470.42
ACD/KOC (pH 7.4): 2848.21
Polar Surface Area: 43 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 203.2±3.0 cm3

Click to predict properties on the Chemicalize site


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