We have found 46587 results matching your criteria.
Please wait while we search...
  1. 1.
    General Material Information
  2. 2.
    PhysChem Properties
  3. 3.
    Occurrences
  4. 4.
    Organoleptic Properties
  5. 5.
    Suppliers
  6. 6.
    Potential Uses
  7. 7.
    Regulatory & Documentation
  8. 8.
    Safety Information
  9. 9.
    Other Information
  10. 10.
    Blenders & Components
  11. 11.
    Literature & References

methyl R-3-acetoxyhexanoate

Chemical Structure

General Material Information

Preferred name methyl R-3-acetoxyhexanoate
Trivial Name Hexanoic acid, 3-(acetyloxy)-, methyl ester, (R)-
Short Description (R)-3-(acetyloxy)hexanoic acid methyl ester
Formula C9 H16 O4
CAS Number 77118-93-5
ECHA Number 278-626-0
FDA UNII ZV2XBH5CBD
Nikkaji Number J226.160J
xLogP3-AA 1.30 (est)
NMR Predictor External link
Synonyms
  • (R)-3-( acetyl oxy) hexanoic acid methyl ester
  • (R)-3-( acetyloxy)hexanoic acid methyl ester
  • methyl R-3-acetyloxyhexanoate
  • methyl-3-acetoxyhexanoate
  • methyl 3-acetyloxyhexanoate
  • Hexanoic acid, 3-(acetyloxy)-, methyl ester, (R)-

US / EU / FDA / JECFA / FEMA / Scholar / Patents

Google Scholar Start search
Google Books Start search
Google Patents Start search
Perfumer & Flavorists Start search
EU Patents Start search
PubMeb Start search
NCBI Start search

Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 188.22331237793
Specific gravity @ 25 °C
Pounds per Gallon 8.429 to 8.479
Refractive Index 1.42 to 1.426 @ 20 °C
Vapor Pressure 0.988 mmHg @ 25 °C
Flash Point TCC Value 93.33 °C TCC
logP (o/w) 1.566 est
Solubility
alcohol Yes
water, 1443 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Green
fruity, green, lettuce
General comment At 100.00 %. fruity green lettuce
Flavor Type: Green
sweet, green
General comment Sweet green

Potential Uses

Applications
Odor purposes Fruit, Green
Flavoring purposes Lettuce

Safety Information

Safety information

Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
information only not used for fragrances or flavors
Recommendation for methyl R-3-acetoxyhexanoate usage levels up to:
not for fragrance use.
Recommendation for methyl R-3-acetoxyhexanoate flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):77118-93-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :89463
National Institute of Allergy and Infectious Diseases:Data
methyl 3-acetyloxyhexanoate
Chemidplus:0077118935