ChemSpider 2D Image | 3-Oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl 2-chloro-6-fluorobenzoate | C15H9ClFNO4

3-Oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl 2-chloro-6-fluorobenzoate

  • Molecular FormulaC15H9ClFNO4
  • Average mass321.688 Da
  • Monoisotopic mass321.020416 Da
  • ChemSpider ID28803581

More details:

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

2-Chloro-6-fluorobenzoate de 3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yle [French] [ACD/IUPAC Name]
3-Oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl 2-chloro-6-fluorobenzoate [ACD/IUPAC Name]
3-Oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl-2-chlor-6-fluorbenzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2-chloro-6-fluoro-, 3,4-dihydro-3-oxo-2H-1,4-benzoxazin-6-yl ester [ACD/Index 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: 526.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.9±30.1 °C
Index of Refraction: 1.604
Molar Refractivity: 75.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.72
ACD/KOC (pH 5.5): 785.01
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.72
ACD/KOC (pH 7.4): 784.99
Polar Surface Area: 65 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 219.4±3.0 cm3

Click to predict properties on the Chemicalize site


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