ChemSpider 2D Image | 2-(BENZYLOXY)-5-TERT-BUTYLPHENYLBORONIC ACID | C17H21BO3

2-(BENZYLOXY)-5-TERT-BUTYLPHENYLBORONIC ACID

  • Molecular FormulaC17H21BO3
  • Average mass284.158 Da
  • Monoisotopic mass284.158386 Da
  • ChemSpider ID28295317

More details:

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

(2-(Benzyloxy)-5-(tert-butyl)phenyl)boronic acid
[2-(Benzyloxy)-5-(2-methyl-2-propanyl)phenyl]boronic acid [ACD/IUPAC Name]
[2-(Benzyloxy)-5-(2-methyl-2-propanyl)phenyl]borsäure [German] [ACD/IUPAC Name]
1220625-04-6 [RN]
2-(BENZYLOXY)-5-TERT-BUTYLPHENYLBORONIC ACID
Acide [2-(benzyloxy)-5-(2-méthyl-2-propanyl)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[5-(1,1-dimethylethyl)-2-(phenylmethoxy)phenyl]- [ACD/Index Name]
MFCD18383785 [MDL number]
(5-tert-butyl-2-phenylmethoxyphenyl)boronic acid
[1220625-04-6] [RN]
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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: 1.1±0.1 g/cm3
    Boiling Point: 460.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.0±3.0 kJ/mol
    Flash Point: 232.3±31.5 °C
    Index of Refraction: 1.564
    Molar Refractivity: 82.9±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.85
    ACD/LogD (pH 5.5): 4.37
    ACD/BCF (pH 5.5): 1237.37
    ACD/KOC (pH 5.5): 5690.22
    ACD/LogD (pH 7.4): 4.35
    ACD/BCF (pH 7.4): 1176.30
    ACD/KOC (pH 7.4): 5409.35
    Polar Surface Area: 50 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 44.7±5.0 dyne/cm
    Molar Volume: 254.8±5.0 cm3

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