Found 106 results

Search term: MF = 'C_{17}H_{10}FN_{3}OS'
ChemSpider 2D Image | (3E)-3-(4-Fluorobenzylidene)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one | C17H10FN3OS

(3E)-3-(4-Fluorobenzylidene)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one

  • Molecular FormulaC17H10FN3OS
  • Average mass323.344 Da
  • Monoisotopic mass323.052856 Da
  • ChemSpider ID22872858

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-3-(4-Fluorbenzyliden)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-on [German] [ACD/IUPAC Name]
(3E)-3-(4-Fluorobenzylidene)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one [ACD/IUPAC Name]
(3E)-3-(4-Fluorobenzylidène)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one [French] [ACD/IUPAC Name]
2H-Pyrimido[2,1-b]benzothiazol-2-one, 3-[(4-fluorophenyl)methylene]-3,4-dihydro-4-imino-, (3E)- [ACD/Index Name]
(3E)-3-[(4-fluorophenyl)methylidene]-4-iminopyrimido[2,1-b][1,3]benzothiazol-2-one
896854-62-9 [RN]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 482.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.7±3.0 kJ/mol
    Flash Point: 245.3±31.5 °C
    Index of Refraction: 1.737
    Molar Refractivity: 88.2±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.49
    ACD/LogD (pH 5.5): 3.15
    ACD/BCF (pH 5.5): 145.47
    ACD/KOC (pH 5.5): 1229.46
    ACD/LogD (pH 7.4): 3.15
    ACD/BCF (pH 7.4): 145.47
    ACD/KOC (pH 7.4): 1229.46
    Polar Surface Area: 82 Å2
    Polarizability: 34.9±0.5 10-24cm3
    Surface Tension: 59.2±7.0 dyne/cm
    Molar Volume: 219.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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