ChemSpider 2D Image | (3-(3-(diethylamino)propoxy)phenyl)boronic acid | C13H22BNO3

(3-(3-(diethylamino)propoxy)phenyl)boronic acid

  • Molecular FormulaC13H22BNO3
  • Average mass251.130 Da
  • Monoisotopic mass251.169281 Da
  • ChemSpider ID32076212

More details:

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

(3-(3-(diethylamino)propoxy)phenyl)boronic acid
{3-[3-(Diethylamino)propoxy]phenyl}boronic acid [ACD/IUPAC Name]
{3-[3-(Diethylamino)propoxy]phenyl}borsäure [German] [ACD/IUPAC Name]
903878-29-5 [RN]
Acide {3-[3-(diéthylamino)propoxy]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[3-(diethylamino)propoxy]phenyl]- [ACD/Index Name]
3-(3-(diethylamino)propoxy)phenylboronic acid
3-[3-(DIETHYLAMINO)PROPOXY]PHENYLBORONIC ACID
4-(N,N-diethylsulfamoyl)phenylboronic acid
850568-76-2 [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 413.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.3±3.0 kJ/mol
    Flash Point: 204.0±31.5 °C
    Index of Refraction: 1.521
    Molar Refractivity: 71.3±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 2.49
    ACD/LogD (pH 5.5): -0.78
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.28
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.10
    Polar Surface Area: 53 Å2
    Polarizability: 28.3±0.5 10-24cm3
    Surface Tension: 42.1±5.0 dyne/cm
    Molar Volume: 234.4±5.0 cm3

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