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Search term: 891771-88-3 (Found by approved synonym)

ChemSpider 2D Image | 4'-Methylsulfinyl-2,2':6',2''-terpyridine | C16H13N3OS

4'-Methylsulfinyl-2,2':6',2''-terpyridine

  • Molecular FormulaC16H13N3OS
  • Average mass295.359 Da
  • Monoisotopic mass295.077942 Da
  • ChemSpider ID21428889

More details:






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

2,2':6',2''-Terpyridine, 4'-(methylsulfinyl)- [ACD/Index Name]
4'-(Methylsulfinyl)-2,2':6',2''-terpyridin
4'-(Methylsulfinyl)-2,2':6',2''-terpyridin [German] [ACD/IUPAC Name]
4'-(Methylsulfinyl)-2,2':6',2''-terpyridine [ACD/IUPAC Name]
4'-(Méthylsulfinyl)-2,2':6',2''-terpyridine
4'-(Méthylsulfinyl)-2,2':6',2''-terpyridine [French] [ACD/IUPAC Name]
4'-Methylsulfinyl-2,2':6',2''-terpyridine
891771-88-3 [RN]
MFCD14636303

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 546.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.4±3.0 kJ/mol
    Flash Point: 284.0±30.1 °C
    Index of Refraction: 1.701
    Molar Refractivity: 83.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.46
    ACD/LogD (pH 5.5): 1.55
    ACD/BCF (pH 5.5): 8.77
    ACD/KOC (pH 5.5): 162.90
    ACD/LogD (pH 7.4): 1.56
    ACD/BCF (pH 7.4): 9.10
    ACD/KOC (pH 7.4): 168.99
    Polar Surface Area: 75 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 82.6±5.0 dyne/cm
    Molar Volume: 214.8±5.0 cm3

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