ChemSpider 2D Image | 1-[5-(2-Thienyl)-1H-pyrazol-3-yl]methanamine | C8H9N3S

1-[5-(2-Thienyl)-1H-pyrazol-3-yl]methanamine

  • Molecular FormulaC8H9N3S
  • Average mass179.242 Da
  • Monoisotopic mass179.051712 Da
  • ChemSpider ID25076953

More details:

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

1-[5-(2-Thienyl)-1H-pyrazol-3-yl]methanamin [German] [ACD/IUPAC Name]
1-[5-(2-Thienyl)-1H-pyrazol-3-yl]methanamine [ACD/IUPAC Name]
1-[5-(2-Thiényl)-1H-pyrazol-3-yl]méthanamine [French] [ACD/IUPAC Name]
1-[5-(thiophen-2-yl)-1H-pyrazol-3-yl]methanamine
1H-Pyrazole-3-methanamine, 5-(2-thienyl)- [ACD/Index Name]
859850-80-9 [RN]
(3-(thiophen-2-yl)-1H-pyrazol-5-yl)methanamine
(3-thiophen-2-yl-1H-pyrazol-5-yl)methanamine
(5-(2-thienyl)pyrazol-3-yl)methylamine
(5-(thiophen-2-yl)-1H-pyrazol-3-yl)methanamine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 400.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.1±3.0 kJ/mol
    Flash Point: 195.8±25.9 °C
    Index of Refraction: 1.662
    Molar Refractivity: 50.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.90
    ACD/LogD (pH 5.5): -1.40
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.27
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 20.26
    Polar Surface Area: 83 Å2
    Polarizability: 19.9±0.5 10-24cm3
    Surface Tension: 63.7±3.0 dyne/cm
    Molar Volume: 135.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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