ChemSpider 2D Image | 3-[(3-Nitro-2-pyridinyl)sulfanyl]aniline | C11H9N3O2S

3-[(3-Nitro-2-pyridinyl)sulfanyl]aniline

  • Molecular FormulaC11H9N3O2S
  • Average mass247.273 Da
  • Monoisotopic mass247.041550 Da
  • ChemSpider ID28603286

More details:

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

3-[(3-Nitro-2-pyridinyl)sulfanyl]anilin [German] [ACD/IUPAC Name]
3-[(3-Nitro-2-pyridinyl)sulfanyl]aniline [ACD/IUPAC Name]
3-[(3-Nitro-2-pyridinyl)sulfanyl]aniline [French] [ACD/IUPAC Name]
Benzenamine, 3-[(3-nitro-2-pyridinyl)thio]- [ACD/Index Name]
{3-[(3-nitropyridin-2-yl)thio]phenyl}amine
1415719-68-4 [RN]
3-((3-Nitropyridin-2-yl)thio)aniline
3-(3-nitropyridin-2-yl)sulfanylaniline
3-[(3-NITROPYRIDIN-2-YL)SULFANYL]ANILINE
3-[(3-nitropyridin-2-yl)thio]aniline
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 437.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.4±3.0 kJ/mol
    Flash Point: 218.6±27.3 °C
    Index of Refraction: 1.704
    Molar Refractivity: 66.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.29
    ACD/LogD (pH 5.5): 2.28
    ACD/BCF (pH 5.5): 31.64
    ACD/KOC (pH 5.5): 411.73
    ACD/LogD (pH 7.4): 2.28
    ACD/BCF (pH 7.4): 31.85
    ACD/KOC (pH 7.4): 414.54
    Polar Surface Area: 110 Å2
    Polarizability: 26.5±0.5 10-24cm3
    Surface Tension: 76.7±5.0 dyne/cm
    Molar Volume: 172.5±5.0 cm3

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