ChemSpider 2D Image | [(3-Ethyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetic acid | C9H10N4O2S

[(3-Ethyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetic acid

  • Molecular FormulaC9H10N4O2S
  • Average mass238.266 Da
  • Monoisotopic mass238.052444 Da
  • ChemSpider ID21804750

More details:

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

[(3-Ethyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetic acid [ACD/IUPAC Name]
[(3-Ethyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[(3-ethyl-1,2,4-triazolo[4,3-b]pyridazin-6-yl)thio]- [ACD/Index Name]
Acide [(3-éthyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acétique [French] [ACD/IUPAC Name]
(3-Ethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-ylsulfanyl)-acetic acid
[(3-ethyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio]acetic acid
1179379-45-3 [RN]
2-((3-Ethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl)acetic acid
2-((3-Ethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetic acid
2-({3-ethyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetic acid
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    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: 1.731
    Molar Refractivity: 61.4±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.37
    ACD/LogD (pH 5.5): -1.87
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.01
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 106 Å2
    Polarizability: 24.3±0.5 10-24cm3
    Surface Tension: 66.6±7.0 dyne/cm
    Molar Volume: 153.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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