Preferred name | hexyl heptanoate |
Trivial Name | Hexyl heptanoate |
Short Description | heptanoic acid, hexyl ester |
Formula | C13 H26 O2 |
CAS Number | 1119-06-8 |
FEMA Number | 4337 |
FDA UNII | G02H8871NA |
Nikkaji Number | J115.082K |
xLogP3-AA | 4.90 (est) |
NMR Predictor | External link |
JECFA Food Flavoring | 1872 hexyl heptanoate |
FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
FDA Mainterm | 1119-06-8 ; HEXYL HEPTANOATE |
Synonyms |
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NCBI | Start search |
hexyl heptanoate | |
NIST Chemistry WebBook: | Search Inchi |
Pubchem (cid): | 517970 |
Pubchem (sid): | 135329058 |
(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): | HMDB32326 |
FooDB: | FDB009576 |
ChemSpider: | View |
Axsyn | M&U International |
Penta International | M&U International LLC |
Penta International Corporation |
Material listed in food chemical codex | No |
Molecular weight | 214.34861755371 |
Specific gravity | @ 20 °C |
Pounds per Gallon | 7.164 to 7.206 |
Refractive Index | 1.426 to 1.43 @ 20 °C |
Boiling Point | 252 to 253°C @ 760 mm Hg |
Acid Value | 1 max KOH/g |
Vapor Pressure | 0.014 mmHg @ 25 °C |
Flash Point TCC Value | 109.44 °C TCC |
logP (o/w) | 5.371 est |
Solubility | |
alcohol | Yes |
water, 1.132 mg/L @ 25 °C (est) | Yes |
water | No |
Odor Type: Green | |
foliage, green, leafy, cognac | |
General comment | At 100.00 %. dank foliage mallow leaves green |
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 |
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 hexyl heptanoate usage levels up to: | |||
6.0000 % in the fragrance concentrate. | |||
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: 23 | |||
Click here to view publication 23 | |||
average usual ppm | average maximum ppm | ||
baked goods: | - | - | |
beverages(nonalcoholic): | 0.20000 | 1.00000 | |
beverages(alcoholic): | 0.40000 | 2.00000 | |
breakfast cereal: | - | - | |
cheese: | - | - | |
chewing gum: | - | - | |
condiments / relishes: | - | - | |
confectionery froastings: | - | - | |
egg products: | - | - | |
fats / oils: | - | - | |
fish products: | - | - | |
frozen dairy: | - | - | |
fruit ices: | 0.50000 | 2.50000 | |
gelatins / puddings: | - | - | |
granulated sugar: | - | - | |
gravies: | - | - | |
hard candy: | 1.00000 | 5.00000 | |
imitation dairy: | - | - | |
instant coffee / tea: | - | - | |
jams / jellies: | 0.50000 | 2.50000 | |
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: | - | - |
EPI System: View |
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EPA ACToR:Toxicology Data |
EPA Substance Registry Services (SRS):Registry |
Laboratory Chemical Safety Summary :517970 |
National Institute of Allergy and Infectious Diseases:Data |
hexyl heptanoate |
Chemidplus:0001119068 |