ChemSpider 2D Image | (1E)-3-(Allylsulfinyl)-1-[(~2~H_5_)-2-propen-1-yldisulfanyl]-1-propene | C9H9D5OS3

(1E)-3-(Allylsulfinyl)-1-[(2H5)-2-propen-1-yldisulfanyl]-1-propene

  • Molecular FormulaC9H9D5OS3
  • Average mass239.433 Da
  • Monoisotopic mass239.052063 Da
  • ChemSpider ID107439897

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

(1E)-3-(Allylsulfinyl)-1-[(2H5)-2-propen-1-yldisulfanyl]-1-propen [German] [ACD/IUPAC Name]
(1E)-3-(Allylsulfinyl)-1-[(2H5)-2-propen-1-yldisulfanyl]-1-propene [ACD/IUPAC Name]
(1E)-3-(Allylsulfinyl)-1-[(2H5)-2-propén-1-yldisulfanyl]-1-propène [French] [ACD/IUPAC Name]
Disulfide, 2-propen-1-yl-d5 (1E)-3-(2-propen-1-ylsulfinyl)-1-propen-1-yl [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 376.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 181.2±27.9 °C
Index of Refraction: 1.603
Molar Refractivity: 68.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 80.84
ACD/KOC (pH 5.5): 807.40
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 80.84
ACD/KOC (pH 7.4): 807.40
Polar Surface Area: 87 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 198.3±3.0 cm3

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