Found 1529 results

Search term: MF = 'C_{9}H_{16}N_{4}O_{3}S'
ChemSpider 2D Image | {1-[1-(Methylsulfonyl)-3-piperidinyl]-1H-1,2,3-triazol-4-yl}methanol | C9H16N4O3S

{1-[1-(Methylsulfonyl)-3-piperidinyl]-1H-1,2,3-triazol-4-yl}methanol

  • Molecular FormulaC9H16N4O3S
  • Average mass260.313 Da
  • Monoisotopic mass260.094299 Da
  • ChemSpider ID53616893

More details:

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

{1-[1-(Methylsulfonyl)-3-piperidinyl]-1H-1,2,3-triazol-4-yl}methanol [German] [ACD/IUPAC Name]
{1-[1-(Methylsulfonyl)-3-piperidinyl]-1H-1,2,3-triazol-4-yl}methanol [ACD/IUPAC Name]
{1-[1-(Méthylsulfonyl)-3-pipéridinyl]-1H-1,2,3-triazol-4-yl}méthanol [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-methanol, 1-[1-(methylsulfonyl)-3-piperidinyl]- [ACD/Index Name]
(1-(1-(methylsulfonyl)piperidin-3-yl)-1H-1,2,3-triazol-4-yl)methanol
2097965-01-8 [RN]
MFCD30003800

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 496.3±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.5±3.0 kJ/mol
    Flash Point: 254.0±31.5 °C
    Index of Refraction: 1.677
    Molar Refractivity: 63.4±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.42
    ACD/LogD (pH 5.5): -0.81
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 8.65
    ACD/LogD (pH 7.4): -0.81
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 8.65
    Polar Surface Area: 97 Å2
    Polarizability: 25.1±0.5 10-24cm3
    Surface Tension: 65.9±7.0 dyne/cm
    Molar Volume: 168.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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