Articles:
Notes:
Introduces naturalness to floral fruity fragrances. Topnote effects in rose and citrus. Flavouring ingredient. Present in pineapple, banana and apple
| Fragrance Demo Formulas Flavor Demo Formulas | ||
| Name: | ethyl nonanoate | |
| CAS Number: | 123-29-5 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 204-615-7 | |
| FDA UNII: | KSH683S98J | |
| Nikkaji Web: | J5.539E | |
| Beilstein Number: | 1759169 | |
| MDL: | MFCD00009570 | |
| FEMA Number: | 2447 | |
| CoE Number: | 388 | |
| XlogP3-AA: | 4.00 (est) | |
| Molecular Weight: | 186.29474000 | |
| Formula: | C11 H22 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 34 ethyl nonanoate |
| Flavis Number: | 09.107 (Old) |
| DG SANTE Food Flavourings: | 09.107 ethyl nonanoate |
| FEMA Number: | 2447 ethyl nonanoate |
| FDA Mainterm: | ETHYL NONANOATE |
| FDA Regulation: | |
| FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION Subpart F--Flavoring Agents and Related Substances Sec. 172.515 Synthetic flavoring substances and adjuvants. | |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 98.00 to 100.00 % |
| Food Chemicals Codex Listed: | Yes |
| Specific Gravity: | 0.86300 to 0.86500 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.181 to 7.198 |
| Refractive Index: | 1.42100 to 1.42600 @ 20.00 °C. |
| Melting Point: | -45.00 to -44.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 119.00 °C. @ 23.00 mm Hg |
| Boiling Point: | 228.00 to 229.00 °C. @ 760.00 mm Hg |
| Acid Value: | 1.00 max. KOH/g |
| Vapor Pressure: | 0.116000 mmHg @ 25.00 °C. (est) |
| Vapor Density: | 6.4 ( Air = 1 ) |
| Flash Point: | 170.00 °F. TCC ( 76.67 °C. ) |
| logP (o/w): | 4.350 (est) |
| Shelf Life: | 24.00 month(s) or longer if stored properly. |
| Storage: | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Soluble in: | |
| alcohol | |
| propylene glycol | |
| water, 10.87 mg/L @ 25 °C (est) | |
| water, 29.5 mg/L @ 25 °C (exp) | |
| Insoluble in: | |
| water | |
| Similar Items: note | |
| allyl nonanoate | |
| amyl nonanoate | |
| isoamyl nonanoate | |
| benzyl nonanoate | |
| butyl nonanoate | |
| isobutyl nonanoate | |
| geranyl nonanoate | |
| heptyl nonanoate | |
| hexyl nonanoate | |
| methyl nonanoate | |
| nonyl nonanoate | |
| octyl nonanoate | |
| phenethyl nonanoate | |
| propyl nonanoate | |
| isopropyl nonanoate | |
Organoleptic Properties:
| Odor Type: | waxy |
| Odor Strength: | medium |
| Odor Description: at 100.00 %. | fruity rose waxy rum wine natural tropical |
| Substantivity: | 12 Hour(s) |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
emollients perfuming agents |
Safety Information:
| Most important hazard(s): | |
| Xi - Irritant | |
|
R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing. | |
| Human Experience: | 12 % solution: no irritation or sensitization. |
| Oral/Parenteral Toxicity: | |
|
oral-rat LD50 > 43000 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: OTHER CHANGES Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. oral-guinea pig LD50 24000 mg/kg GASTROINTESTINAL: ULCERATION OR BLEEDING FROM DUODENUM GASTROINTESTINAL: GASTRITIS Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| Recommendation for ethyl nonanoate usage levels up to: | |||
| 8.0000 % 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: 3 | |||
| Click here to view publication 3 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 15.00000 | |
| beverages(nonalcoholic): | - | 3.90000 | |
| beverages(alcoholic): | - | 20.00000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | 580.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | 39.00000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 4.00000 | |
| fruit ices: | - | 4.00000 | |
| gelatins / puddings: | - | 15.00000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 14.00000 | |
| 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 Authority (EFSA) reference(s): | |
| Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission related to Flavouring Group Evaluation 5: Esters of 23 branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and 24 branched- and straight-chain unsaturated carboxylic acids from chemical groups 1, 2, and 5 View page or View pdf | |
| Flavouring Group Evaluation 5, Revision 1 (FGE.05Rev1):Esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and branched- and straight-chain unsaturated carboxylic acids from chemical groups 1, 2, and 5 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf | |
| 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 | |
| Flavouring Group Evaluation 5, Revision 2 (FGE.05Rev2): Branched- and straight-chain unsaturated carboxylic acids and esters of these with aliphatic saturated alcohols from chemical groups 1, 2, 3 and 5 View page or View pdf | |
| Scientific Opinion on the safety and efficacy of straight-chain primary aliphatic alcohols/aldehydes/acids, acetals and esters with esters containing saturated alcohols and acetals containing saturated aldehydes (chemical group 1) when used as flavourings for all animal species View page or View pdf | |
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 123-29-5 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 31251 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| ethyl nonanoate | |
| Chemidplus: | 0000123295 |
| RTECS: | RA6845000 for cas# 123-29-5 |
References:
| ethyl nonanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 123-29-5 |
| Pubchem (cid): | 31251 |
| Pubchem (sid): | 134974390 |
| Pherobase: | View |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2009 |
| (IUPAC): | Atomic Weights of the Elements 2009 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Everything Added to Food in the United States (EAFUS): | View |
| CHEBI: | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB40193 |
| FooDB: | FDB019905 |
| YMDB (Yeast Metabolome Database): | YMDB01354 |
| Export Tariff Code: | 2915.90.1800 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| apple | FR | |
| apricot | FR | |
| banana | FR | |
| butter | FR | |
| chamomile | FR | |
| cherry | FR | |
| coffee | FR | |
| cognac | FR | |
| elder berry | FR | |
| fir needle oil replacer | FR | |
| floral | FR | |
| freesia | FR | |
| grape | FR | |
| honey | FR | |
| hop | FR | |
| licorice | FR | |
| melon | FR | |
| mulberry | FR | |
| orris | FR | |
| peach | FR | |
| pear | FR | |
| pineapple | FR | |
| plum | FR | |
| plum greengage plum | FL | |
| raisin | FR | |
| rose | FR | |
| sherry | FR | |
| strawberry | FR | |
| tonka bean | FR | |
| topnotes | ||
| tropical | FL | |
| tuberose | FR | |
| valerian | FL/FR | |
| wine | FR | |
| woodruff | FR |
Occurrence (nature, food, other): note
| apple fruit Search PMC Picture | |
| banana fruit Search Trop Picture | |
| beer Search PMC Picture | |
| brandy grape brandy Search PMC Picture | |
| cognac Search PMC Picture | |
| elderberry Search Trop Picture | |
| grape Search Trop Picture | |
| pineapple fruit Search Trop Picture | |
| plum fruit Search Trop Picture | |
| raisin Search PMC Picture | |
| rum Search PMC Picture | |
| whiskey Search Picture | |
| wine red wine Search Picture | |
| wine white wine Search Picture |
Synonyms:
| ethyl nonanoate | |
| ethyl nonanoate (ethyl pelargonate) | |
| ethyl nonanoate (pelargonate) | |
| ethyl nonanoate FCC | |
| ethyl nonylate | |
| ethyl pelargonate | |
| ethyl pelargonate FCC | |
| ethyl pelargonate natural | |
| ethyl-pelargonate (ethyl-nonanoate) | |
| nonanoic acid ethyl ester | |
| nonanoic acid, ethyl ester | |
| wine ether |