Found 1529 results

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

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

  • Molecular FormulaC9H16N4O3S
  • Average mass260.313 Da
  • Monoisotopic mass260.094299 Da
  • ChemSpider ID53616896

More details:

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

(1-{[1-(Methylsulfonyl)-3-pyrrolidinyl]methyl}-1H-1,2,3-triazol-4-yl)methanol [German] [ACD/IUPAC Name]
(1-{[1-(Methylsulfonyl)-3-pyrrolidinyl]methyl}-1H-1,2,3-triazol-4-yl)methanol [ACD/IUPAC Name]
(1-{[1-(Méthylsulfonyl)-3-pyrrolidinyl]méthyl}-1H-1,2,3-triazol-4-yl)méthanol [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-methanol, 1-[[1-(methylsulfonyl)-3-pyrrolidinyl]methyl]- [ACD/Index Name]
(1-((1-(methylsulfonyl)pyrrolidin-3-yl)methyl)-1H-1,2,3-triazol-4-yl)methanol
2097995-90-7 [RN]
MFCD30003803

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 486.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.2±3.0 kJ/mol
    Flash Point: 247.7±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: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -1.63
    ACD/LogD (pH 5.5): -1.01
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 6.71
    ACD/LogD (pH 7.4): -1.01
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 6.71
    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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