Products 75272-81-0

CAS 75272-81-0 appears in our catalog under these names: 8-(Methylsulfinyl) Octyl Isothiocyanate, 1–Isothiocyanato–8–(methylsulfinyl)–octane, 1-Isothiocyanato-8-(methylsulfinyl)-octane, 1-Isothiocyanato-8-(methylsulfinyl)octane, ≥98%, ≥98%, 8-Methylsulfinyloctyl isothiocyanate, 99.72%. Offered by: TRC, GLPBio, Biosynth, Chemat, MedChemExpress. Available pack sizes: 500mg, 100mg, 25mg, 50mg, 5mg, 10mg, 250mg, 5 mg.

Structural formula: {0} (CAS {1})

8-(methylsulfinyl)octyl isothiocyanate is a member of the class of isothiocyanates that is octyl isothiocyanate in which one of the methyl hydrogens at position 8 has been replaced by a methylsulfinyl group. It has a role as an allelochemical and a plant metabolite. It is a sulfoxide and an isothiocyanate. It derives from a hydride of an octane.

Source: ChEBI

Identity
Molecular formulaC10H19NOS2
Molecular weight233.4 g/mol
IUPAC name1-isothiocyanato-8-methylsulfinyloctane
InChIKeyBCRXKWOQVFKZAG-UHFFFAOYSA-N
SMILESCS(=O)CCCCCCCCN=C=S

Computed by PubChem (NCBI)