ChemSpider 2D Image | 4-Methyl-3,4-dihydro-2H-1,4-benzoxazin-7-ylboronic acid | C9H12BNO3

4-Methyl-3,4-dihydro-2H-1,4-benzoxazin-7-ylboronic acid

  • Molecular FormulaC9H12BNO3
  • Average mass193.008 Da
  • Monoisotopic mass193.091019 Da
  • ChemSpider ID21614011

More details:

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

(4-Methyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl)boronic acid [ACD/IUPAC Name]
(4-Methyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl)borsäure [German] [ACD/IUPAC Name]
499769-86-7 [RN]
4-methyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl boronic acid
4-Methyl-3,4-dihydro-2H-1,4-benzoxazin-7-ylboronic acid
Acide (4-méthyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(3,4-dihydro-4-methyl-2H-1,4-benzoxazin-7-yl)- [ACD/Index Name]
(4-Methyl-3,4-dihydro-2H-benzo[b][1,4]oxazin-7-yl)boronic acid
(4-methyl-3,4-dihydro-2H-benzo[b][1,4]oxazin-7-yl)boronic acid(WXC08439)
[499769-86-7] [RN]
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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: 405.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.3±3.0 kJ/mol
    Flash Point: 199.2±31.5 °C
    Index of Refraction: 1.593
    Molar Refractivity: 50.7±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.09
    ACD/LogD (pH 5.5): 1.13
    ACD/BCF (pH 5.5): 3.89
    ACD/KOC (pH 5.5): 82.48
    ACD/LogD (pH 7.4): 1.23
    ACD/BCF (pH 7.4): 4.91
    ACD/KOC (pH 7.4): 103.97
    Polar Surface Area: 53 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 53.7±5.0 dyne/cm
    Molar Volume: 149.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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