ChemSpider 2D Image | (3-fluoro-4-(2-(4-hydroxypiperidin-1-yl)ethoxy)phenyl)boronic acid | C13H19BFNO4

(3-fluoro-4-(2-(4-hydroxypiperidin-1-yl)ethoxy)phenyl)boronic acid

  • Molecular FormulaC13H19BFNO4
  • Average mass283.104 Da
  • Monoisotopic mass283.139130 Da
  • ChemSpider ID34980229

More details:

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

(3-fluoro-4-(2-(4-hydroxypiperidin-1-yl)ethoxy)phenyl)boronic acid
{3-Fluor-4-[2-(4-hydroxy-1-piperidinyl)ethoxy]phenyl}borsäure [German] [ACD/IUPAC Name]
{3-Fluoro-4-[2-(4-hydroxy-1-piperidinyl)ethoxy]phenyl}boronic acid [ACD/IUPAC Name]
1704064-11-8 [RN]
Acide {3-fluoro-4-[2-(4-hydroxy-1-pipéridinyl)éthoxy]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-fluoro-4-[2-(4-hydroxy-1-piperidinyl)ethoxy]phenyl]- [ACD/Index Name]
{3-FLUORO-4-[2-(4-HYDROXYPIPERIDIN-1-YL)ETHOXY]PHENYL}BORONIC ACID
3-fluoro-4-(2-(4-hydroxypiperidin-1-yl)ethoxy)phenylboronic acid
3-FLUORO-4-[2-(4-HYDROXYPIPERIDIN-1-YL)ETHOXY]PHENYLBORONIC ACID
MFCD28400174

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 494.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.3±3.0 kJ/mol
    Flash Point: 253.1±31.5 °C
    Index of Refraction: 1.563
    Molar Refractivity: 70.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.67
    ACD/LogD (pH 5.5): -1.31
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.18
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 12.56
    Polar Surface Area: 73 Å2
    Polarizability: 28.1±0.5 10-24cm3
    Surface Tension: 53.4±5.0 dyne/cm
    Molar Volume: 218.2±5.0 cm3

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