ChemSpider 2D Image | (1-(Phenylsulfonyl)-1H-indol-4-yl)boronic acid | C14H12BNO4S

(1-(Phenylsulfonyl)-1H-indol-4-yl)boronic acid

  • Molecular FormulaC14H12BNO4S
  • Average mass301.125 Da
  • Monoisotopic mass301.058014 Da
  • ChemSpider ID26465759

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

(1-(Phenylsulfonyl)-1H-indol-4-yl)boronic acid
[1-(Phenylsulfonyl)-1H-indol-4-yl]boronic acid [ACD/IUPAC Name]
[1-(Phenylsulfonyl)-1H-indol-4-yl]borsäure [German] [ACD/IUPAC Name]
1256358-55-0 [RN]
Acide [1-(phénylsulfonyl)-1H-indol-4-yl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[1-(phenylsulfonyl)-1H-indol-4-yl]- [ACD/Index Name]
[1-(Benzenesulfonyl)-1H-indol-4-yl]boronic acid
[1256358-55-0] [RN]
1-(BENZENESULFONYL)INDOL-4-YLBORONIC ACID
1-benzenesulfonyl-1h-indole-4-boronic acid
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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: 1.4±0.1 g/cm3
    Boiling Point: 581.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 91.5±3.0 kJ/mol
    Flash Point: 305.4±32.9 °C
    Index of Refraction: 1.633
    Molar Refractivity: 79.7±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.08
    ACD/LogD (pH 5.5): 2.44
    ACD/BCF (pH 5.5): 42.39
    ACD/KOC (pH 5.5): 508.27
    ACD/LogD (pH 7.4): 2.37
    ACD/BCF (pH 7.4): 35.46
    ACD/KOC (pH 7.4): 425.14
    Polar Surface Area: 88 Å2
    Polarizability: 31.6±0.5 10-24cm3
    Surface Tension: 55.7±7.0 dyne/cm
    Molar Volume: 223.1±7.0 cm3

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