ChemSpider 2D Image | Methyl 6-chloro-5-fluoronicotinate | C7H5ClFNO2

Methyl 6-chloro-5-fluoronicotinate

  • Molecular FormulaC7H5ClFNO2
  • Average mass189.572 Da
  • Monoisotopic mass188.999283 Da
  • ChemSpider ID23348485

More details:

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

3-Pyridinecarboxylic acid, 6-chloro-5-fluoro-, methyl ester [ACD/Index Name]
6-Chloro-5-fluoronicotinate de méthyle [French] [ACD/IUPAC Name]
78686-78-9 [RN]
Methyl 6-chloro-5-fluoronicotinate [ACD/IUPAC Name]
Methyl-6-chlor-5-fluornicotinat [German] [ACD/IUPAC Name]
2-Chloro-3-fluoro-5-(methoxycarbonyl)pyridine
3-PYRIDINECARBOXYLIC ACID,6-CHLORO-5-FLUORO-,METHYL ESTER
6-Chloro-5-fluoropyridine-3-carboxylic acid methyl ester
Methyl 2-chloro-3-fluoro-5-pyridinecarboxylate
Methyl 2-chloro-3-fluoropyridine-5-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

499862 Sigma-Aldrich [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 232.6±40.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 46.9±3.0 kJ/mol
    Flash Point: 94.4±27.3 °C
    Index of Refraction: 1.512
    Molar Refractivity: 41.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.88
    ACD/LogD (pH 5.5): 1.56
    ACD/BCF (pH 5.5): 8.97
    ACD/KOC (pH 5.5): 167.34
    ACD/LogD (pH 7.4): 1.56
    ACD/BCF (pH 7.4): 8.97
    ACD/KOC (pH 7.4): 167.34
    Polar Surface Area: 39 Å2
    Polarizability: 16.3±0.5 10-24cm3
    Surface Tension: 42.6±3.0 dyne/cm
    Molar Volume: 136.7±3.0 cm3

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