CAS 4864-61-3
:3-Octyl acetate
Description:
3-Octyl acetate, with the CAS number 4864-61-3, is an organic compound classified as an ester. It is formed from the reaction of octanol and acetic acid. This substance typically appears as a colorless to pale yellow liquid with a characteristic fruity odor, making it useful in flavoring and fragrance applications. Its molecular structure consists of a long hydrophobic octyl chain, which contributes to its solubility properties, allowing it to dissolve in organic solvents while being less soluble in water. 3-Octyl acetate has a relatively low boiling point and moderate volatility, which makes it suitable for use in various industrial applications, including as a solvent and in the production of coatings and adhesives. Additionally, it is considered to have low toxicity, although proper handling and safety measures should always be observed. Its pleasant aroma and flavor profile also make it a candidate for use in food and cosmetic products, although regulatory guidelines must be followed to ensure safety and compliance.
Formula:C10H20O2
InChI:InChI=1S/C10H20O2/c1-4-6-7-8-10(5-2)12-9(3)11/h10H,4-8H2,1-3H3
InChI key:InChIKey=STZUZYMKSMSTOU-UHFFFAOYSA-N
SMILES:C(CCCCC)(OC(C)=O)CC
Synonyms:- (±)-3-Acetoxyoctane
- 1-Ethyl hexyl acetate
- 3-Octanol acetate
- 3-Octanol, 3-acetate
- Amyl ethyl carbinyl acetate
- Einecs 225-471-1
- FEMA No. 3583
- Oct-3-yl ethanoate
- 3-Octyl acetate
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