ChemSpider 2D Image | 4-(3-fluorophenoxy)phenylboronic acid | C12H10BFO3

4-(3-fluorophenoxy)phenylboronic acid

  • Molecular FormulaC12H10BFO3
  • Average mass232.015 Da
  • Monoisotopic mass232.070709 Da
  • ChemSpider ID26533564

More details:

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

(4-(3-Fluorophenoxy)phenyl)boronic acid
[4-(3-Fluorophenoxy)phenyl]boronic acid [ACD/IUPAC Name]
[4-(3-Fluorophenoxy)phenyl]-boronic acid
[4-(3-Fluorphenoxy)phenyl]borsäure [German] [ACD/IUPAC Name]
1029438-36-5 [RN]
4-(3-fluorophenoxy)phenylboronic acid
Acide [4-(3-fluorophénoxy)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-(3-fluorophenoxy)phenyl]- [ACD/Index Name]
MFCD14636485 [MDL number]
(R)-2-Amino-4-(2-aminophenyl)-4-oxobutanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 373.7±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.5±3.0 kJ/mol
    Flash Point: 179.8±30.7 °C
    Index of Refraction: 1.587
    Molar Refractivity: 59.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.77
    ACD/LogD (pH 5.5): 2.95
    ACD/BCF (pH 5.5): 102.46
    ACD/KOC (pH 5.5): 956.41
    ACD/LogD (pH 7.4): 2.92
    ACD/BCF (pH 7.4): 96.03
    ACD/KOC (pH 7.4): 896.46
    Polar Surface Area: 50 Å2
    Polarizability: 23.7±0.5 10-24cm3
    Surface Tension: 49.1±5.0 dyne/cm
    Molar Volume: 178.1±5.0 cm3

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