Found 6 results

Search term: MF = 'C_{3}H_{4}BNO_{2}S'
ChemSpider 2D Image | isothiazol-5-ylboronic acid | C3H4BNO2S

isothiazol-5-ylboronic acid

  • Molecular FormulaC3H4BNO2S
  • Average mass128.945 Da
  • Monoisotopic mass129.005585 Da
  • ChemSpider ID26263180

More details:

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

1,2-Thiazol-5-ylboronic acid [ACD/IUPAC Name]
1,2-Thiazol-5-ylborsäure [German] [ACD/IUPAC Name]
1162262-34-1 [RN]
Acide 1,2-thiazol-5-ylboronique [French] [ACD/IUPAC Name]
Boronic acid, B-5-isothiazolyl- [ACD/Index Name]
isothiazol-5-ylboronic acid
(1,2-thiazol-5-yl)boronic acid
[1162262-34-1] [RN]
isothazole-5-boronic acid
Isothiazol-5-yl boronic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 196.5±46.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 45.7±3.0 kJ/mol
    Flash Point: 72.6±29.0 °C
    Index of Refraction: 1.565
    Molar Refractivity: 29.2±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.18
    ACD/LogD (pH 5.5): 0.54
    ACD/BCF (pH 5.5): 1.51
    ACD/KOC (pH 5.5): 46.46
    ACD/LogD (pH 7.4): 0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 17.33
    Polar Surface Area: 82 Å2
    Polarizability: 11.6±0.5 10-24cm3
    Surface Tension: 62.2±5.0 dyne/cm
    Molar Volume: 89.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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