ChemSpider 2D Image | 1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) | C14H16N2O14S4

1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid)

  • Molecular FormulaC14H16N2O14S4
  • Average mass564.542 Da
  • Monoisotopic mass563.948425 Da
  • ChemSpider ID110462

More details:

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

1,1'-{Disulfandiylbis[(1-oxo-3,1-propandiyl)oxy]}bis(2,5-dioxo-3-pyrrolidinsulfonsäure) [German] [ACD/IUPAC Name]
1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) [ACD/IUPAC Name]
3-Pyrrolidinesulfonic acid, 1,1'-[dithiobis[(1-oxo-3,1-propanediyl)oxy]]bis[2,5-dioxo- [ACD/Index Name]
81069-02-5 [RN]
Acide 1,1'-{disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonique) [French] [ACD/IUPAC Name]
1,1'-((3,3'-Disulfanediylbis(propanoyl))bis(oxy))bis(2,5-dioxopyrrolidine-3-sulfonic acid)
1-[3-[[3-(2,5-dioxo-3-sulfopyrrolidin-1-yl)oxy-3-oxopropyl]disulfanyl]propanoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid
1-{[3-({3-[(2,5-DIOXO-3-SULFOPYRROLIDIN-1-YL)OXY]-3-OXOPROPYL}DISULFANYL)PROPANOYL]OXY}-2,5-DIOXOPYRROLIDINE-3-SULFONIC ACID
3,3'-dithiobis(sulfosuccinimidyl propionate)
3,3'-dithiobis(sulfosuccinimidylpropanoate)
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.9±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.693
    Molar Refractivity: 111.4±0.4 cm3
    #H bond acceptors: 16
    #H bond donors: 2
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 2
    ACD/LogP: -5.79
    ACD/LogD (pH 5.5): -10.11
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -10.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 303 Å2
    Polarizability: 44.2±0.5 10-24cm3
    Surface Tension: 114.5±5.0 dyne/cm
    Molar Volume: 290.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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