Found 582 results

Search term: MF = 'C_{7}H_{12}N_{4}O_{3}S'
ChemSpider 2D Image | {1-[1-(Methylsulfonyl)-3-azetidinyl]-1H-1,2,3-triazol-4-yl}methanol | C7H12N4O3S

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

  • Molecular FormulaC7H12N4O3S
  • Average mass232.260 Da
  • Monoisotopic mass232.063004 Da
  • ChemSpider ID53616895

More details:

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

{1-[1-(Methylsulfonyl)-3-azetidinyl]-1H-1,2,3-triazol-4-yl}methanol [German] [ACD/IUPAC Name]
{1-[1-(Methylsulfonyl)-3-azetidinyl]-1H-1,2,3-triazol-4-yl}methanol [ACD/IUPAC Name]
{1-[1-(Méthylsulfonyl)-3-azétidinyl]-1H-1,2,3-triazol-4-yl}méthanol [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-methanol, 1-[1-(methylsulfonyl)-3-azetidinyl]- [ACD/Index Name]
(1-(1-(methylsulfonyl)azetidin-3-yl)-1H-1,2,3-triazol-4-yl)methanol
2091183-37-6 [RN]
MFCD30003802

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 487.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.3±3.0 kJ/mol
    Flash Point: 248.3±31.5 °C
    Index of Refraction: 1.727
    Molar Refractivity: 54.1±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -2.25
    ACD/LogD (pH 5.5): -1.50
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.63
    ACD/LogD (pH 7.4): -1.50
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.63
    Polar Surface Area: 97 Å2
    Polarizability: 21.5±0.5 10-24cm3
    Surface Tension: 76.3±7.0 dyne/cm
    Molar Volume: 136.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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