ChemSpider 2D Image | (5-Chloro-2-fluoro-4-methylphenyl)boronic acid | C7H7BClFO2

(5-Chloro-2-fluoro-4-methylphenyl)boronic acid

  • Molecular FormulaC7H7BClFO2
  • Average mass188.392 Da
  • Monoisotopic mass188.021164 Da
  • ChemSpider ID21469188

More details:

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

(5-Chlor-2-fluor-4-methylphenyl)borsäure [German] [ACD/IUPAC Name]
(5-Chloro-2-fluoro-4-methylphenyl)boronic acid [ACD/IUPAC Name]
1072952-42-1 [RN]
Acide (5-chloro-2-fluoro-4-méthylphényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(5-chloro-2-fluoro-4-methylphenyl)- [ACD/Index Name]
(5-chloranyl-2-fluoranyl-4-methyl-phenyl)boronic acid
[1072952-42-1] [RN]
4-Borono-2-chloro-5-fluorotoluene
5-CHLORO-2-FLUORO-4-METHYL BENZENE BORONIC ACID
5-Chloro-2-fluoro-4-methylbenzeneboronic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 318.3±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.1±3.0 kJ/mol
    Flash Point: 146.3±30.7 °C
    Index of Refraction: 1.528
    Molar Refractivity: 42.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.65
    ACD/LogD (pH 5.5): 2.42
    ACD/BCF (pH 5.5): 40.34
    ACD/KOC (pH 5.5): 489.83
    ACD/LogD (pH 7.4): 2.21
    ACD/BCF (pH 7.4): 25.22
    ACD/KOC (pH 7.4): 306.19
    Polar Surface Area: 40 Å2
    Polarizability: 17.0±0.5 10-24cm3
    Surface Tension: 42.1±5.0 dyne/cm
    Molar Volume: 139.2±5.0 cm3

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