ChemSpider 2D Image | (5-Acetyl-2-methoxyphenyl)boronic acid | C9H11BO4

(5-Acetyl-2-methoxyphenyl)boronic acid

  • Molecular FormulaC9H11BO4
  • Average mass193.992 Da
  • Monoisotopic mass194.075043 Da
  • ChemSpider ID24597749

More details:

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

(5-Acetyl-2-methoxyphenyl)boronic acid [ACD/IUPAC Name]
(5-Acetyl-2-methoxyphenyl)borsäure [German] [ACD/IUPAC Name]
1215281-20-1 [RN]
Acide (5-acétyl-2-méthoxyphényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(5-acetyl-2-methoxyphenyl)- [ACD/Index Name]
(5-Acetyl-2-methoxy-phenyl)boronic acid
[1215281-20-1] [RN]
1722-26-5 [RN]
3999-38-0 [RN]
4-(4-Butyl-5-mercapto-4H-1,2,4-triazol-3-yl)phenol
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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: 1.2±0.1 g/cm3
    Boiling Point: 411.6±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.0±3.0 kJ/mol
    Flash Point: 202.7±31.5 °C
    Index of Refraction: 1.528
    Molar Refractivity: 49.0±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.11
    ACD/LogD (pH 5.5): 1.20
    ACD/BCF (pH 5.5): 4.77
    ACD/KOC (pH 5.5): 106.39
    ACD/LogD (pH 7.4): 1.04
    ACD/BCF (pH 7.4): 3.35
    ACD/KOC (pH 7.4): 74.66
    Polar Surface Area: 67 Å2
    Polarizability: 19.4±0.5 10-24cm3
    Surface Tension: 45.8±5.0 dyne/cm
    Molar Volume: 159.1±5.0 cm3

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