Found 762 results

Search term: MF = 'C_{12}H_{9}ClFNO_{3}'
ChemSpider 2D Image | 5-(2-Chloro-6-fluorobenzoyl)-2-oxa-5-azabicyclo[2.2.1]heptan-3-one | C12H9ClFNO3

5-(2-Chloro-6-fluorobenzoyl)-2-oxa-5-azabicyclo[2.2.1]heptan-3-one

  • Molecular FormulaC12H9ClFNO3
  • Average mass269.656 Da
  • Monoisotopic mass269.025513 Da
  • ChemSpider ID30747835

More details:

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

2-Oxa-5-azabicyclo[2.2.1]heptan-3-one, 5-(2-chloro-6-fluorobenzoyl)- [ACD/Index Name]
5-(2-Chlor-6-fluorbenzoyl)-2-oxa-5-azabicyclo[2.2.1]heptan-3-on [German] [ACD/IUPAC Name]
5-(2-Chloro-6-fluorobenzoyl)-2-oxa-5-azabicyclo[2.2.1]heptan-3-one [ACD/IUPAC Name]
5-(2-Chloro-6-fluorobenzoyl)-2-oxa-5-azabicyclo[2.2.1]heptan-3-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: 497.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.7±28.7 °C
Index of Refraction: 1.605
Molar Refractivity: 60.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.85
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.66
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.66
Polar Surface Area: 47 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 177.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement