ChemSpider 2D Image | 2-Chlorobenzo[d]thiazol-5-ol | C7H4ClNOS

2-Chlorobenzo[d]thiazol-5-ol

  • Molecular FormulaC7H4ClNOS
  • Average mass185.631 Da
  • Monoisotopic mass184.970215 Da
  • ChemSpider ID38772853

More details:

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

1261737-67-0 [RN]
2-Chlor-1,3-benzothiazol-5-ol [German] [ACD/IUPAC Name]
2-Chloro-1,3-benzothiazol-5-ol [ACD/IUPAC Name]
2-Chloro-1,3-benzothiazol-5-ol [French] [ACD/IUPAC Name]
2-Chlorobenzo[d]thiazol-5-ol
5-Benzothiazolol, 2-chloro- [ACD/Index Name]
2-chloro-5-hydroxybenzothiazole
95%
MFCD18415693

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 326.2±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.1±3.0 kJ/mol
    Flash Point: 151.1±20.4 °C
    Index of Refraction: 1.746
    Molar Refractivity: 47.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.68
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 32.46
    ACD/KOC (pH 5.5): 419.26
    ACD/LogD (pH 7.4): 2.09
    ACD/BCF (pH 7.4): 20.51
    ACD/KOC (pH 7.4): 264.92
    Polar Surface Area: 61 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 71.6±3.0 dyne/cm
    Molar Volume: 116.6±3.0 cm3

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