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Flavouring 3-Mercaptohexyl acetate
Synonym(s) 3-Thiohexyl acetate
3-Thiohexyl ethanoate
Latest JECFA evaluation 1999 (Session 53)
Status of specification Full
Chemical name 3-Mercaptohexyl acetate
JECFA number 554
CAS number 136954-20-6  
FEMA number 3851
COE number -
FLAVIS number -
Molecular weight 176.28 
Chemical formula C8H16O2S  
Physical form/odour clear liquid 
Solubility insoluble in water; soluble in ethanol and heptane 
Solubility in ethanol -
Boiling point (°C) 186
Assay min % 81.7
Acid value max -
Refractive index 1.462-1.472
Specific gravity 0.991-0.996
Other requirements Also contains min. 8.2% 3-Mercaptohexanol and 9.7% 3-Acetylmercaptohexyl acetate
ID Test IR, MS, NMR
Spectrum http://www.fao.org/ag/agn/jecfa-flav/img/img/554.gif



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