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Online Edition: "Specifications for Flavourings"

Flavouring Mixture of 3-Hydroxy-5-methyl-2-hexanone and 2-Hydroxy-5-methyl-3-hexanone
Synonym(s)
Latest JECFA evaluation 2010 (Session 73)
Status of specification Full
Chemical name Mixture of 3-hydroxy-5-methylhexan-2-one and 2-hydroxy-5-methylhexan-3-one
JECFA number 2034
CAS number 163038-04-8;246511-74-0
FEMA number 3989
COE number
FLAVIS number
Molecular weight 130.18
Chemical formula C7H14O2
Physical form/odour Colourless liquid; Sweet, chocolate-like aroma
Solubility Soluble in water
Solubility in ethanol Soluble
Boiling point (°C) 39-41° (0.06 mm Hg)
Assay min % 97%
Acid value max
Refractive index 1.424-1.434
Specific gravity 0.922-0.932
Other requirements Mixture: 77% 3-Hydroxy-5-methyl-2-hexanone; 20% 2-Hydroxy-5-methyl-3-hexanone
ID Test HNMR IR MS
Spectrum