ChemSpider 2D Image | 5-(pyridin-3-yl)-1,2-dihydro-1,2,4-triazol-3-one | C7H6N4O

5-(pyridin-3-yl)-1,2-dihydro-1,2,4-triazol-3-one

  • Molecular FormulaC7H6N4O
  • Average mass162.149 Da
  • Monoisotopic mass162.054153 Da
  • ChemSpider ID28424970

More details:

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

3-(pyridin-3-yl)-4,5-dihydro-1H-1,2,4-triazol-5-one
3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3-pyridinyl)- [ACD/Index Name]
5-(3-Pyridinyl)-1,2-dihydro-3H-1,2,4-triazol-3-on [German] [ACD/IUPAC Name]
5-(3-Pyridinyl)-1,2-dihydro-3H-1,2,4-triazol-3-one [ACD/IUPAC Name]
5-(3-Pyridinyl)-1,2-dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]
5-(pyridin-3-yl)-1,2-dihydro-1,2,4-triazol-3-one
5-(pyridin-3-yl)-2,3-dihydro-1H-1,2,4-triazol-3-one
59282-83-6 [RN]
(E)-Methyl 7-((1R,2R,3R)-3-Hydroxy-2-((R,E)-3-hydroxy-4,4-dimethyloct-1-en-1-yl)-5-oxocyclopentyl)hept-2-enoate
3-(Pyridin-3-yl)-1H-1,2,4-triazol-5(4H)-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.757
    Molar Refractivity: 42.8±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -1.28
    ACD/LogD (pH 5.5): -0.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.45
    ACD/LogD (pH 7.4): -0.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.43
    Polar Surface Area: 66 Å2
    Polarizability: 17.0±0.5 10-24cm3
    Surface Tension: 68.2±7.0 dyne/cm
    Molar Volume: 104.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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