3-OCTYL ACETATE
- CAS NO.:4864-61-3
- Empirical Formula: C10H20O2
- Molecular Weight: 172.26
- MDL number: MFCD00015349
- EINECS: 225-471-1
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-06-27 15:50:30
What is 3-OCTYL ACETATE?
Description
3-Octyl acetate has a characteristic, complex aroma with a rose and jasmine note and an apple-lemon undertone with a sweet, peach-like flavor.
Chemical properties
3-Octyl acetate has a characteristic, complex aroma with a rose and jasmine note and an apple-lemon undertone with a sweet, peach-like flavor.
Occurrence
Reported found in the peppermint and pennyroyal oil (Mentha pulegium L.), spearmint oil (Mentha spicata L.), Scotch spearmint oil (Mentha cardiaca Ger.), other Mentha oils and heated beef fat.
The Uses of 3-OCTYL ACETATE
3-Octyl acetate has found some use in perfumery as a modifier in floral-herbaceous fragrance types, since it blends equally well. with Lavender and Rose, with Opopanax and Geranium, etc. It is also used as a modifier in minty fragrance types to introduce freshness and mild, warm notes without the weedy green notes often accompanying the Mint materials. There is a considerable difference between the odor of this ester and the acetates of the isomer Octanols. Unfortunately, the title ester is one of the comparatively expensive Octanylacetates, and its use is therefore somewhat restricted. It should not be confused with the acetate of Ethyl-iso-amyl carbinol which is an inexpensive, industrial petrochemical of entirely different odor type.
Definition
ChEBI: 3-Octyl acetate is a carboxylic ester.
Taste threshold values
Taste characteristics at 10 ppm: green, oily and waxy with a weak minty and tropical nuance.
Synthesis
3-Octyl acetate is prepared by direct esteritication of 3-Octanol with Acetic acid or Acetic anhydride.
Properties of 3-OCTYL ACETATE
Melting point: | -65.75°C (estimate) |
Boiling point: | 99 °C18 mm Hg(lit.) |
Density | 0.86 g/mL at 25 °C(lit.) |
refractive index | n |
FEMA | 3583 | 3-OCTYL ACETATE |
Flash point: | 157 °F |
Odor | at 100.00 %. fresh bergamot woody green grapefruit rose apple mint |
JECFA Number | 313 |
EPA Substance Registry System | 3-Octanol, acetate (4864-61-3) |
Safety information for 3-OCTYL ACETATE
Signal word | Warning |
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P337+P313:IF eye irritation persists: Get medical advice/attention. |
Computed Descriptors for 3-OCTYL ACETATE
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