3,5,5-Trimethylhexyl acetate Structure

3,5,5-Trimethylhexyl acetate

Chemical Properties

Melting point -26°C (estimate)
Boiling point 209 °C
Density  0,87 g/cm3
vapor pressure  1.36hPa at 25℃
refractive index  1.4200-1.4230
FLAVIS Number 09.819 | 3,5,5-Trimethylhexyl acetate
Flash point 79°C
form  clear liquid
color  A colourless liquid with a fruit-like odour of moderate tenacity
Odor at 100.00 %. sweet orris cumin woody fruity spicy
Odor Type herbal
Water Solubility  19.1mg/L at 20℃
Cosmetics Ingredients Functions PERFUMING
LogP 4.6 at 25℃
CAS DataBase Reference 58430-94-7
FDA UNII 9HMD71U17Z
EPA Substance Registry System 1-Hexanol, 3,5,5-trimethyl-, acetate (58430-94-7)

Safety

Signal wordWarning
Hazard statements H227
Precautionary statements P210-P280-P370+P378-P403+P235-P501
RTECS  AK0840000
TSCA  TSCA listed
HS Code  2915.39.9000
Toxicity The acute oral LD50 in rats was reported as 4.25 g/kg (3.54-4.96 g/kg) (Moreno, 1973). The acute dermal LD50 in rabbits was reported as > 5 g/kg (Moreno, 1973).
NFPA 704:
2
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