ChemSpider 2D Image | 2,2'-(1,3-Propanediyldisulfinyl)diethanol | C7H16O4S2

2,2'-(1,3-Propanediyldisulfinyl)diethanol

  • Molecular FormulaC7H16O4S2
  • Average mass228.329 Da
  • Monoisotopic mass228.048996 Da
  • ChemSpider ID30647702

More details:

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

2,2'-(1,3-Propandiyldisulfinyl)diethanol [German] [ACD/IUPAC Name]
2,2'-(1,3-Propanediyldisulfinyl)diethanol [ACD/IUPAC Name]
2,2'-(1,3-Propanediyldisulfinyl)diéthanol [French] [ACD/IUPAC Name]
2,2'-(propane-1,3-diyldisulfinyl)bis(ethan-1-ol)
76305-83-4 [RN]
Ethanol, 2,2'-(1,3-propanediyldisulfinyl)bis- [ACD/Index Name]
2,2'-(Propane-1,3-diyldisulfinyl)di(ethan-1-ol)
2,2'-(Propane-1,3-diyldisulfinyl)diethanol
2-[3-(2-HYDROXYETHANESULFINYL)PROPANESULFINYL]ETHAN-1-OL
2-[3-(2-HYDROXYETHANESULFINYL)PROPANESULFINYL]ETHANOL
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 599.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.9 mmHg at 25°C
    Enthalpy of Vaporization: 102.4±6.0 kJ/mol
    Flash Point: 316.5±28.7 °C
    Index of Refraction: 1.616
    Molar Refractivity: 55.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: -3.39
    ACD/LogD (pH 5.5): -2.40
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.18
    ACD/LogD (pH 7.4): -2.40
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.18
    Polar Surface Area: 113 Å2
    Polarizability: 21.9±0.5 10-24cm3
    Surface Tension: 89.3±3.0 dyne/cm
    Molar Volume: 158.1±3.0 cm3

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