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Online Edition: "Specifications for Flavourings"

Flavouring 6-(Methylthio)hexyl isothiocyanate
Synonym(s)
Latest JECFA evaluation 2008 (Session 69)
Status of specification Full
Chemical name 1-Isothiocyanato-6-(methylthio)-hexane
JECFA number 1897
CAS number 4430-39-1
FEMA number 4415
COE number
FLAVIS number
Molecular weight 189.34
Chemical formula C8H15NS2
Physical form/odour Pale yellow liquid; Penetrating raddish-like aroma
Solubility Very slightly soluble in water; freely soluble in ether
Solubility in ethanol Soluble
Boiling point (°C) 128-129° (1 mm Hg)
Assay min % 95%
Acid value max
Refractive index 1.534-1.540
Specific gravity 1.035-1.041 (20°)
Other requirements
ID Test MS
Spectrum