ChemSpider 2D Image | 2-Bromobenzo[d]thiazol-6-ol | C7H4BrNOS

2-Bromobenzo[d]thiazol-6-ol

  • Molecular FormulaC7H4BrNOS
  • Average mass230.082 Da
  • Monoisotopic mass228.919693 Da
  • ChemSpider ID23499308

More details:

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

2-Brom-1,3-benzothiazol-6-ol [German] [ACD/IUPAC Name]
2-Bromo-1,3-benzothiazol-6-ol [ACD/IUPAC Name]
2-Bromo-1,3-benzothiazol-6-ol [French] [ACD/IUPAC Name]
2-Bromobenzo[d]thiazol-6-ol
6-Benzothiazolol, 2-bromo- [ACD/Index Name]
808755-67-1 [RN]
[808755-67-1] [RN]
1-Phenyl-1,3-propanediol [ACD/IUPAC Name]
1-phenylpropane-1,3-diol
2-Bromo-6-Benzo[d]thiazolol
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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: 1.9±0.1 g/cm3
    Boiling Point: 373.8±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.5±3.0 kJ/mol
    Flash Point: 179.9±25.7 °C
    Index of Refraction: 1.768
    Molar Refractivity: 50.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.84
    ACD/LogD (pH 5.5): 2.36
    ACD/BCF (pH 5.5): 36.33
    ACD/KOC (pH 5.5): 455.13
    ACD/LogD (pH 7.4): 2.28
    ACD/BCF (pH 7.4): 30.74
    ACD/KOC (pH 7.4): 385.07
    Polar Surface Area: 61 Å2
    Polarizability: 19.9±0.5 10-24cm3
    Surface Tension: 73.5±3.0 dyne/cm
    Molar Volume: 120.9±3.0 cm3

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