3,5,5-trimethylhexyl acetate

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Structural formula
Structural formula of 3,5,5-trimethylhexyl acetate
General
Surname 3,5,5-trimethylhexyl acetate
other names
  • Trimethylhexyl acetate
  • Isononyl acetate
  • Nonanyl acetate
Molecular formula C 11 H 22 O 2
Brief description

colorless liquid with a fruity odor

External identifiers / databases
CAS number 58430-94-7
EC number 261-245-9
ECHA InfoCard 100.055.659
PubChem 42745
ChemSpider 38985
Wikidata Q2823829
properties
Molar mass 186.29 g mol −1
Physical state

liquid

boiling point

207.1 ° C

solubility

practically insoluble in water (19.1 mg l −1 at 20 ° C)

safety instructions
GHS labeling of hazardous substances
07 - Warning 09 - Dangerous for the environment

Caution

H and P phrases H: 315-411
P: 264-273-280-302 + 352-332 + 313
As far as possible and customary, SI units are used. Unless otherwise noted, the data given apply to standard conditions .

3,5,5-Trimethylhexyl acetate is a chemical compound from the group of carboxylic acid esters .

Extraction and presentation

3,5,5-trimethylhexyl acetate can be obtained by oxo synthesis of diisobutene , followed by hydrogenation to alcohol and acetylation .

properties

3,5,5-Trimethylhexyl acetate is a flammable, hardly inflammable, colorless liquid with a fruity odor, which is practically insoluble in water.

use

3,5,5-trimethylhexyl acetate is used as a fragrance .

safety instructions

The vapors of 3,5,5-trimethylhexyl acetate can form an explosive mixture with air ( flash point 70 ° C).

Individual evidence

  1. ↑ a b c d e f g h Entry on 3,5,5-trimethylhexyl acetate in the GESTIS substance database of the IFA , accessed on July 6, 2019(JavaScript required) .
  2. ^ A b Horst Surburg, Johannes Panten: Common Fragrance and Flavor Materials Preparation, Properties and Uses . John Wiley & Sons, 2006, ISBN 978-3-527-60789-1 , pp. 317 ( limited preview in Google Book search).