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Search term: 1133116-31-0 (Found by synonym)
ChemSpider 2D Image | 1,5-Bis[(3-bromophenyl)sulfonyl]-1,5-diazocane | C18H20Br2N2O4S2

1,5-Bis[(3-bromophenyl)sulfonyl]-1,5-diazocane

  • Molecular FormulaC18H20Br2N2O4S2
  • Average mass552.300 Da
  • Monoisotopic mass549.923096 Da
  • ChemSpider ID25950045

More details:

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

1,5-Bis[(3-bromophenyl)sulfonyl]-1,5-diazocane [ACD/IUPAC Name]
1,5-Bis[(3-bromophényl)sulfonyl]-1,5-diazocane [French] [ACD/IUPAC Name]
1,5-Bis[(3-bromphenyl)sulfonyl]-1,5-diazocan [German] [ACD/IUPAC Name]
1,5-Diazocine, 1,5-bis[(3-bromophenyl)sulfonyl]octahydro- [ACD/Index Name]
(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-methyl-tetrahydrofuran-3,4-diol
[1133116-31-0] [RN]
1,5-Bis((3-bromophenyl)sulfonyl)-1,5-diazocane
1,5-Bis(3-bromobenzene-1-sulfonyl)-1,5-diazocane
1,5-bis(3-bromobenzenesulfonyl)-1,5-diazocane
1,5-Bis(3-bromophenylsulfonyl)-1,5-diazocane
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 648.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.6±3.0 kJ/mol
    Flash Point: 346.0±34.3 °C
    Index of Refraction: 1.632
    Molar Refractivity: 118.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 2
    ACD/LogP: 5.70
    ACD/LogD (pH 5.5): 5.08
    ACD/BCF (pH 5.5): 4264.40
    ACD/KOC (pH 5.5): 13798.94
    ACD/LogD (pH 7.4): 5.08
    ACD/BCF (pH 7.4): 4264.40
    ACD/KOC (pH 7.4): 13798.94
    Polar Surface Area: 92 Å2
    Polarizability: 46.8±0.5 10-24cm3
    Surface Tension: 55.3±3.0 dyne/cm
    Molar Volume: 330.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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