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Online Edition: "Specifications for Flavourings"

Flavouring Phenethyl isothiocyanate
Synonym(s) 2-Phenylethyl isothiocyanate;Isothiocyanic acid, phenethyl ester;beta-Phenethyl isothiocyanate
Latest JECFA evaluation 2005 (Session 65)
Status of specification Full
Chemical name Phenethyl isothiocyanate
JECFA number 1563
CAS number 130638
FEMA number 4014
COE number
FLAVIS number 12.193
Molecular weight 163.24
Chemical formula C9H9NS
Physical form/odour Nearly Colourless liquid; Strong green irritating aroma
Solubility Insoluble in water; Soluble in triacetin and heptane
Solubility in ethanol Soluble
Boiling point (°C) 139-140°
Assay min % 99%
Acid value max 1
Refractive index 1.586-1.590
Specific gravity 1.087-1.097
Other requirements
ID Test HNMR IR MS
Spectrum