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amyl heptanoate

Chemical Structure

General Material Information

Preferred name amyl heptanoate
Trivial Name Pentyl heptanoate
Short Description amyl heptoate
Formula C12 H24 O2
CAS Number 7493-82-5
FEMA Number 2073
Flavis Number 9.098
ECHA Number 231-342-0
FDA UNII I91PDA80HT
Nikkaji Number J115.081B
COE Number 370
xLogP3-AA 4.40 (est)
NMR Predictor External link
JECFA Food Flavoring 170 N-amyl heptanoate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 7493-82-5 ; AMYL HEPTANOATE
Synonyms
  • N- amyl heptanoate
  • amyl heptoate
  • amyl heptylate
  • amyl oenanthate
  • heptanoic acid pentyl ester
  • heptanoic acid, pentyl ester
  • pentyl heptanoate
  • NSC 46129

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):HMDB36225
FooDB:FDB015083
Export Tariff Code:2915.90.0000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 200.32168579102
Melting Point -57.1 to -49.5°C @ 760 mm Hg
Boiling Point 243 to 245.4°C @ 760 mm Hg
Acid Value 1 max KOH/g
Vapor Pressure 0.035 mmHg @ 25 °C
Flash Point TCC Value 72.22 °C TCC
logP (o/w) 4.861 est
Solubility
alcohol Yes
water, 3.517 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Fruity
ethereal, fruity, banana unripe banana, coconut, lemon
General comment At 100.00 %. ethereal fruity unripe banana coconut lemon
Flavor Type: Fruity
fruity, banana
General comment Fruity banana

Occurrences

Potential Uses

Applications
Odor purposes Banana, Fruit
Flavoring purposes Tropical

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 amyl heptanoate usage levels up to:
8.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.61 (μg/capita/day)
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
Click here to view publication 3
average usual ppmaverage maximum ppm
baked goods: -3.00000
beverages(nonalcoholic): -7.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: -53.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -3.80000
fruit ices: -3.80000
gelatins / puddings: -3.50000
granulated sugar: --
gravies: --
hard candy: -7.50000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --

Safety references

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

European Food Safety Authority (EFSA) reference(s):

Flavouring Group Evaluation 2, Revision 1 (FGE.02) : Branched- and straight-chain aliphatic saturated primary alcohols and related esters of primary alcohols and straight-chain carboxylic acids and one straight-chain aldehyde from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):7493-82-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :61415
National Institute of Allergy and Infectious Diseases:Data
pentyl heptanoate
Chemidplus:0007493825