Articles:
| None found yet. Try the PubMed Search. |
Notes:
Found in guava Pisidium guajava, cheeses, peanut and brandy. Food flavour
| Fragrance Demo Formulas | ||
| Name: | 2-phenylethyl propanoate | |
| CAS Number: | 122-70-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 204-567-7 | |
| FDA UNII: | 9VFI60EUHW | |
| Nikkaji Web: | J53.891D | |
| Beilstein Number: | 2097455 | |
| MDL: | MFCD00027008 | |
| FEMA Number: | 2867 | |
| CoE Number: | 418 | |
| XlogP3: | 2.80 (est) | |
| Molecular Weight: | 178.23098000 | |
| Formula: | C11 H14 O2 | |
| BioActivity Summary: | listing | |
| 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: | 990 phenethyl propionate |
| Flavis Number: | 09.137 (Old) |
| DG SANTE Food Flavourings: | 09.137 phenethyl propionate |
| FEMA Number: | 2867 phenethyl propionate |
| FDA Mainterm: | PHENETHYL PROPIONATE |
| 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:
Organoleptic Properties:
| Odor Type: | floral |
| Odor Strength: | medium |
| Odor Description: at 100.00 %. | floral red rose fruity honey balsam styrax |
| Substantivity: | 96 Hour(s) |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
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: | 8 % solution: no irritation or sensitization. |
| Oral/Parenteral Toxicity: | |
|
gavage-rat LD50 [sex: M,F] 3980 mg/kg 5 Test substance administered as phenethyl propionate and eugenol, in a 7:3 ratio. (Beroza et al., 1975) oral-rat LD50 4000 mg/kg (Moreno, 1973f) oral-rat LD50 4000 mg/kg Food and Cosmetics Toxicology. Vol. 12, Pg. 963, 1974. | |
| Dermal Toxicity: | |
|
skin-rabbit LD50 > 5000 mg/kg Food and Cosmetics Toxicology. Vol. 12, Pg. 963, 1974. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| Recommendation for phenethyl propionate usage levels up to: | |||
| 20.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.97 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 3.00 (μg/capita/day) | ||
| Structure Class: | I | ||
| 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: | - | 16.00000 | |
| beverages(nonalcoholic): | - | 3.60000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 11.00000 | |
| fruit ices: | - | 11.00000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 12.00000 | |
| 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:
| Flavor & Extract Manufacturers Association (FEMA) reference(s): | |
| The FEMA GRAS assessment of phenethyl alcohol, aldehydes, acids, and related acetals and esters used as flavor ingredients.View pdf | |
| 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): | |
| Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to: Flavouring Group Evaluation 14 (FGE.14): Phenethyl alcohol, aldehyde, esters, and related phenylacetic acid esters from chemical group 15 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf | |
| Flavouring Group Evaluation 53 (FGE.53): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) structurally related to phenethyl alcohol, aldehyde, esters and related phenylacetic acid esters evaluated by EFSA in FGE.14 (2005) and one phenoxyethyl ester evaluated in FGE.23 (2006) (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 14, Revision 1 (FGE.14Rev1): Phenethyl alcohol, aldehyde, acetals, carboxylic acid and related esters from chemical group 15 and 22 [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf | |
| Flavouring Group Evaluation 53, Revision 1 (FGE.53Rev1): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) FGE.23Rev1 (2008) View page or View pdf | |
| EPI System: | View |
| NLM Hazardous Substances Data Bank: | Search |
| EPA Substance Registry Services (TSCA): | 122-70-3 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 31225 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| 2-phenylethyl propanoate | |
| Chemidplus: | 0000122703 |
| RTECS: | UF6488000 for cas# 122-70-3 |
References:
| 2-phenylethyl propanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 122-70-3 |
| Pubchem (cid): | 31225 |
| Pubchem (sid): | 134974048 |
| 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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB35013 |
| FooDB: | FDB013618 |
| Export Tariff Code: | 2915.50.2000 |
| Haz-Map: | View |
| Household Products: | Search |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| RSC Learn Chemistry: | View |
Potential Blenders and core components note
Potential Uses:
| acacia | FR | |
| almond blossom | FR | |
| almond toasted almond | FL | |
| apple | FR | |
| apple blossom | FR | |
| crabapple | FR | |
| apple green apple | FR | |
| apple red apple | FR | |
| apricot | FR | |
| balsam | FR | |
| beer | FL | |
| blackberry | FR | |
| bouquet | FR | |
| boysenberry | FR | |
| brandy cherry brandy | FL | |
| carnation | FR | |
| cheese | FL | |
| cherry | FR | |
| cherry black cherry | FR | |
| cherry blossom | FR | |
| cloudberry bakeapple | FL | |
| clove blossom | FR | |
| country meadow | FR | |
| crabapple blossom | FR | |
| currant bud absolute replacer | FL/FR | |
| date | FR | |
| dillenia | FR | |
| eglantine | FR | |
| floral | FR | |
| frangipani plumeria | FR | |
| freesia | FR | |
| hawthorn | FR | |
| heather | FR | |
| hibiscus | FR | |
| honey | FR | |
| kewda | FR | |
| kiwi blossom | FR | |
| kumquat | FR | |
| lily of the valley | FR | |
| linden flower | FR | |
| lotus | FR | |
| mandarin | FR | |
| mango flower | FR | |
| millefleurs | FR | |
| mimosa | FR | |
| modifier | ||
| necterine | FL | |
| orchid | FR | |
| pansy | FR | |
| papaya | FR | |
| passion blossom | FR | |
| passion fruit | FR | |
| peach | FR | |
| peanut | FR | |
| pear | FR | |
| peony | FR | |
| pineapple | FR | |
| plum | FR | |
| plum blossom | FR | |
| quince | FR | |
| rhubarb | FR | |
| rose | FR | |
| rose geranium | FR | |
| rose moss rose | FR | |
| rose red rose | FR | |
| rose tea rose | FR | |
| scented stock | FR | |
| stephanotis | FR | |
| sweet pea | FR | |
| tangerine | FR | |
| tea | FL | |
| tropical | FL | |
| tuberose | FR | |
| wallflower | FR | |
| wisteria | FR | |
| ylang ylang | FR |
Occurrence (nature, food, other): note
| champaca absolute (michelia alba dc.) @ 0.12% Data GC Search Trop Picture | |
| champaca concrete @ 0.10% Data GC Search Trop Picture | |
| cheese Search PMC Picture | |
| cinnamon ceylon cinnamon leaf Search Trop Picture | |
| eucalyptus globulus bicostata oil @ 0.21% Data GC Search Trop Picture | |
| eucalyptus globulus oil @ 0.17% Data GC Search Trop Picture | |
| eucalyptus globulus pseudoglobulus oil @ 0.08% Data GC Search Trop Picture | |
| peanut Search Trop Picture |
Synonyms:
| benzcarbinyl propionate | |
| benzyl carbinyl propionate | |
| benzylcarbinyl propionate | |
| japanese beetle bait | |
| phenethyl alcohol propionate | |
| phenethyl alcohol, propionate | |
| phenethyl popanoate | |
| 2- | phenethyl propionate |
| phenyl ethyl alcohol propionate | |
| 2- | phenyl ethyl propanoate |
| phenyl ethyl propionate | |
| 2- | phenyl ethyl propionate |
| phenyl ethyl propionate natural | |
| phenylethanol propanoate | |
| phenylethyl propanoate | |
| 2- | phenylethyl propanoate |
| phenylethyl-propionate | |
| propanoic acid 2-phenethyl ester | |
| propanoic acid 2-phenyl ethyl ester | |
| propanoic acid, 2-phenylethyl ester | |
| propionic acid 2-phenylethyl ester | |
| propionic acid phenethyl ester | |
| propionic acid phenyl ethyl ester | |
| propionic acid, 2-phenylethyl ester | |
| propionic acid, phenethyl ester |