ChemSpider 2D Image | 1,3-Benzothiazole-4-carbaldehyde | C8H5NOS

1,3-Benzothiazole-4-carbaldehyde

  • Molecular FormulaC8H5NOS
  • Average mass163.196 Da
  • Monoisotopic mass163.009186 Da
  • ChemSpider ID27261602

More details:

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

1,3-Benzothiazol-4-carbaldehyd [German] [ACD/IUPAC Name]
1,3-Benzothiazole-4-carbaldehyde [ACD/IUPAC Name]
1,3-Benzothiazole-4-carbaldéhyde [French] [ACD/IUPAC Name]
1213833-90-9 [RN]
4-Benzothiazolecarboxaldehyde [ACD/Index Name]
4-benzothiazolecarbaldehyde
benzo[d]thiazole-4-carbaldehyde
MFCD22394756

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 311.4±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.2±3.0 kJ/mol
    Flash Point: 142.1±20.4 °C
    Index of Refraction: 1.735
    Molar Refractivity: 47.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.43
    ACD/LogD (pH 5.5): 1.44
    ACD/BCF (pH 5.5): 7.35
    ACD/KOC (pH 5.5): 145.13
    ACD/LogD (pH 7.4): 1.44
    ACD/BCF (pH 7.4): 7.35
    ACD/KOC (pH 7.4): 145.13
    Polar Surface Area: 58 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 64.0±3.0 dyne/cm
    Molar Volume: 117.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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