ChemSpider 2D Image | Allyl[(2E)-3-(allyldisulfanyl)-2-propen-1-yl]sulfoniumolate | C9H14OS3

Allyl[(2E)-3-(allyldisulfanyl)-2-propen-1-yl]sulfoniumolate

  • Molecular FormulaC9H14OS3
  • Average mass234.402 Da
  • Monoisotopic mass234.020676 Da
  • ChemSpider ID34988446

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Allyl[(2E)-3-(allyldisulfanyl)-2-propen-1-yl]sulfoniumolat [German] [ACD/IUPAC Name]
Allyl[(2E)-3-(allyldisulfanyl)-2-propen-1-yl]sulfoniumolate [ACD/IUPAC Name]
Allyl[(2E)-3-(allyldisulfanyl)-2-propén-1-yl]sulfoniumolate [French] [ACD/IUPAC Name]
Sulfonium, hydroxy-2-propen-1-yl[(2E)-3-(2-propen-1-yldithio)-2-propen-1-yl]-, inner salt [ACD/Index Name]
3-{[(1E)-3-[(R)-PROP-2-ENE-1-SULFINYL]PROP-1-EN-1-YL]DISULFANYL}PROP-1-ENE
92284-99-6 [RN]
92285-01-3 [RN]
ajoene [Wiki]
AJOENE, (E)-
UNII-99A0041VG8
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.603
Molar Refractivity: 68.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 74 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 198.3±3.0 cm3

Click to predict properties on the Chemicalize site


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