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Search term: MF = 'C_{12}H_{6}ClFN_{2}O'
ChemSpider 2D Image | 2-[(5-Chloro-3-pyridinyl)oxy]-6-fluorobenzonitrile | C12H6ClFN2O

2-[(5-Chloro-3-pyridinyl)oxy]-6-fluorobenzonitrile

  • Molecular FormulaC12H6ClFN2O
  • Average mass248.640 Da
  • Monoisotopic mass248.015274 Da
  • ChemSpider ID48524318

More details:

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

2-[(5-Chlor-3-pyridinyl)oxy]-6-fluorbenzonitril [German] [ACD/IUPAC Name]
2-[(5-Chloro-3-pyridinyl)oxy]-6-fluorobenzonitrile [ACD/IUPAC Name]
2-[(5-Chloro-3-pyridinyl)oxy]-6-fluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-[(5-chloro-3-pyridinyl)oxy]-6-fluoro- [ACD/Index 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: 351.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 166.3±27.9 °C
Index of Refraction: 1.607
Molar Refractivity: 60.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 148.82
ACD/KOC (pH 5.5): 1249.61
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 148.83
ACD/KOC (pH 7.4): 1249.77
Polar Surface Area: 46 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 59.0±5.0 dyne/cm
Molar Volume: 175.1±5.0 cm3

Click to predict properties on the Chemicalize site


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