ChemSpider 2D Image | (4-(Hydroxy(phenyl)methyl)phenyl)boronic acid | C13H13BO3

(4-(Hydroxy(phenyl)methyl)phenyl)boronic acid

  • Molecular FormulaC13H13BO3
  • Average mass228.051 Da
  • Monoisotopic mass228.095779 Da
  • ChemSpider ID28638666

More details:

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

(4-(Hydroxy(phenyl)methyl)phenyl)boronic acid
{4-[Hydroxy(phenyl)methyl]phenyl}boronic acid [ACD/IUPAC Name]
{4-[Hydroxy(phenyl)methyl]phenyl}borsäure [German] [ACD/IUPAC Name]
1221823-69-3 [RN]
Acide {4-[hydroxy(phényl)méthyl]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-(hydroxyphenylmethyl)phenyl]- [ACD/Index Name]
[1221823-69-3] [RN]
4-[Hydroxy(phenyl)methyl]benzeneboronic acid
4-[HYDROXY(PHENYL)METHYL]PHENYLBORONIC ACID
4-hydroxy(phenyl)methylphenylboronic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 446.5±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 74.3±3.0 kJ/mol
    Flash Point: 223.8±29.3 °C
    Index of Refraction: 1.624
    Molar Refractivity: 64.1±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.11
    ACD/LogD (pH 5.5): 2.02
    ACD/BCF (pH 5.5): 20.25
    ACD/KOC (pH 5.5): 299.65
    ACD/LogD (pH 7.4): 2.00
    ACD/BCF (pH 7.4): 19.18
    ACD/KOC (pH 7.4): 283.81
    Polar Surface Area: 61 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 56.9±5.0 dyne/cm
    Molar Volume: 181.6±5.0 cm3

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