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3-nonanon-1-yl acetate

Chemical Structure

General Material Information

Preferred name 3-nonanon-1-yl acetate
Trivial Name 1-(Acetyloxy)-3-nonanone
Short Description (+/-)-nonan-3-yl acetate
Formula C11 H20 O3
CAS Number 7779-54-6
FDA UNII Search
Nikkaji Number J1.536.539K
COE Number 2076
xLogP3-AA 2.20 (est)
NMR Predictor External link
FDA Mainterm 7779-54-6 ; 3-NONANON-1-YL ACETATE
Synonyms
  • 1-( acetyl oxy)-3-nonanone
  • 1-( acetyloxy)-3-nonanone
  • ethyl hexyl carbinyl acetate
  • ethylhexylcarbinyl acetate
  • 1-hydroxy-3-nonanone acetate
  • methylol methyl hexyl ketone acetate
  • (+/-)- nonan-3-yl acetate
  • (±)- nonan-3-yl acetate
  • 3-nonanone, 1-(acetyloxy)-
  • 3-nonanone, 1-hydroxy-, acetate
  • 3-nonanone, 1-hydroxy, acetate
  • 3-oxo nonanyl acetate
  • 3-keto nonyl acetate
  • sec- nonyl acetate
  • 3-oxononyl acetate
  • 3-Nonanone, 1-(acetyloxy)-
  • 3-Nonanone, 1-hydroxy-, acetate
  • 1-(Acetyloxy)-3-nonanone
  • 1-Hydroxy-3-nonanone acetate
  • 1-Acetoxy-3-nonanone

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

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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
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB37179
FooDB:FDB016177
Export Tariff Code:2915.39.9050
ChemSpider:View

Suppliers

Parchem

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 200.27799987793
Specific gravity @ 25 °C
Pounds per Gallon
Vapor Pressure 0.004 mmHg @ 25 °C
Flash Point TCC Value 117.6 °C TCC
logP (o/w) 2.768 est
Solubility
alcohol Yes
dipropylene glycol Yes
water, 520.3 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
fruity, floral, waxy, reseda
General comment At 100.00 %. fruity floral waxy mignonette
Flavor Type: Fruity
peach
General comment Peach

Potential Uses

Applications
Odor purposes Apricot, Carnation, Chypre, Fern, Peach, Reseda, Rose

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:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for 3-nonanon-1-yl acetate usage levels up to:
3.0000 % in the fragrance concentrate.
Recommendation for 3-nonanon-1-yl acetate flavor usage levels up to:
18.0000 ppm in the finished product.
Maximised Survey-derived Daily Intakes (MSDI-EU): 3.00 (μg/capita/day)

Safety references

European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12678469
National Institute of Allergy and Infectious Diseases:Data
3-oxononyl acetate
Chemidplus:0007779546