ChemSpider 2D Image | 1-[2-(Ethylsulfonyl)ethyl]-5-(1-pyrrolidinylmethyl)-1H-tetrazole | C10H19N5O2S

1-[2-(Ethylsulfonyl)ethyl]-5-(1-pyrrolidinylmethyl)-1H-tetrazole

  • Molecular FormulaC10H19N5O2S
  • Average mass273.355 Da
  • Monoisotopic mass273.125946 Da
  • ChemSpider ID35504404

More details:

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

1-[2-(Ethylsulfonyl)ethyl]-5-(1-pyrrolidinylmethyl)-1H-tetrazol [German] [ACD/IUPAC Name]
1-[2-(Ethylsulfonyl)ethyl]-5-(1-pyrrolidinylmethyl)-1H-tetrazole [ACD/IUPAC Name]
1-[2-(Éthylsulfonyl)éthyl]-5-(1-pyrrolidinylméthyl)-1H-tétrazole [French] [ACD/IUPAC Name]
1H-Tetrazole, 1-[2-(ethylsulfonyl)ethyl]-5-(1-pyrrolidinylmethyl)- [ACD/Index Name]
1-(2-Ethanesulfonyl-ethyl)-5-pyrrolidin-1-ylmethyl-1H-tetrazole
1-(2-ethylsulfonylethyl)-5-(pyrrolidin-1-ylmethyl)tetrazole
MFCD28140761

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 540.1±43.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.8±3.0 kJ/mol
    Flash Point: 280.4±28.2 °C
    Index of Refraction: 1.653
    Molar Refractivity: 70.2±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: -0.52
    ACD/LogD (pH 5.5): -2.83
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.15
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.34
    Polar Surface Area: 89 Å2
    Polarizability: 27.8±0.5 10-24cm3
    Surface Tension: 59.2±7.0 dyne/cm
    Molar Volume: 191.8±7.0 cm3

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