4,5,9-Trithiadodeca-1,6,11-triene 9-oxide
1-(prop-2-enyldisulfanyl)-3-prop-2-enylsulfinylprop-1-ene
Also Known As: Ajoene|Acuagel; Adjoen|(E/Z)-Ajoene|4,5,9-Trithiadodeca-1,6,11-triene 9-oxide|NCI60_004938|4,5,9-trithiadodeca-1,6,11-triene-9-oxide|1-(prop-2-enyldisulfanyl)-3-prop-2-enylsulfinylprop-1-ene|Allyl[(2E)-3-(allyldisulfanyl)-2-propen-1-yl]sulfoniumolate|1-(prop-2-en-1-yldisulfanyl)-3-(prop-2-en-1-ylsulfinyl)prop-1-ene|3-(Prop-2-ene-1-sulfinyl)-1-[(prop-2-en-1-yl)disulfanyl]prop-1-ene
| Molecular Formula | C9H14OS3 |
|---|---|
| Molecular Weight | 234.02068 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 234.02068 |
| Heavy Atoms | 13 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 92285-01-3 |
|---|---|
| SMILES | C=CCSSC=CCS(=O)CC=C |
Product Overview
4,5,9-Trithiadodeca-1,6,11-triene 9-oxide (CAS 92285-01-3), with molecular formula C9H14OS3 and molecular weight 234.02068 g/mol. IUPAC: 1-(prop-2-enyldisulfanyl)-3-prop-2-enylsulfinylprop-1-ene.
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