We have found
46590
results matching your criteria.
Please wait while we search...
isobutyl acetate
General Material Information
| Preferred name | isobutyl acetate |
| Trivial Name | Isobutyl acetate |
| Short Description | acetic acid, isobutyl ester |
| Formula | C6 H12 O2 |
| CAS Number | 110-19-0 |
| FEMA Number | 2175 |
| Flavis Number | 9.005 |
| ECHA Number | 203-745-1 |
| FDA UNII | 7CR47FO6LF |
| Nikkaji Number | J1.972K |
| Beilstein Number | 1741909 |
| MDL | MFCD00008932 |
| COE Number | 195 |
| Bio Activity Summary | External link |
| NMR Predictor | External link |
| JECFA Food Flavoring | 137 isobutyl acetate |
| FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm | 110-19-0 ; ISOBUTYL ACETATE |
| Synonyms |
|
US / EU / FDA / JECFA / FEMA / Scholar / Patents
| Google Scholar | Start search |
| Google Books | Start search |
| Google Patents | Start search |
| Perfumer & Flavorists | Start search |
| EU Patents | Start search |
| PubMeb | Start search |
| NCBI | Start search |
Literature & References
| 2-methylpropyl acetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 110-19-0 |
| Pubchem (cid): | 8038 |
| Pubchem (sid): | 134974179 |
| Flavornet: | 110-19-0 |
| Pherobase: | View |
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 |
| CHEBI: | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB31246 |
| FooDB: | FDB003275 |
| YMDB (Yeast Metabolome Database): | YMDB00572 |
| Export Tariff Code: | 2915.34.0000 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| Formulations/Preparations: •grades: technical; solvent; perfume; fcc food chemicals codex. •grade or purity: 95-99+% | |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | Yes |
| Molecular weight | 116.16004180908 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 7.173 to 7.248 |
| Refractive Index | 1.389 to 1.392 @ 20 °C |
| Melting Point | -99 to -98°C @ 760 mm Hg |
| Boiling Point | 45 to 46°C @ 50 mm Hg |
| Acid Value | 1 max KOH/g |
| Vapor Pressure | 17.8 mmHg @ 25 °C |
| Vapor Density | 4 |
| Flash Point TCC Value | 15.56 °C TCC |
| logP (o/w) | 1.78 |
| Solubility | |
| alcohol | Yes |
| fixed oils | Yes |
| propylene glycol | Yes |
| water, 6300 mg/L @ 25 °C (exp) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Fruity | |
| sweet, fruity, ethereal, banana, tropical, apple | |
| Odor strength | medium , recommend smelling in a 10.00 % solution or less |
| Substantivity | < 4 hour(s) at 100.00 % |
| Luebke, William tgsc, (1983) | At 10.00 % in dipropylene glycol. sweet fruity ethereal banana tropical |
| Mosciano, Gerard P&F 15, No. 6, 35, (1990) | Sweet, fruity, etherial with an apple banana nuance |
| Flavor Type: Fruity | |
| sweet, fruity, banana, tutti frutti | |
| Mosciano, Gerard P&F 15, No. 6, 35, (1990) | At 30.00 ppm. Sweet fruity with a banana tutti frutti note |
| Useful in: fruity red, fruity yellow, fruity tropical, fruity others, alcoholics. | Sweet, estery, fruity, banana-like |
| General comment | Diffusive fruity, resembling rum; banana-like on dilution |
Occurrences
| (data available) |
Potential Uses
| Applications | |
| Odor purposes | Apple , Apricot , Banana , Butter , Cherry , Currant , Hyacinth , Peach , Pear , Pineapple , Plum mirabelle plum , Raspberry , Rose , Saffron , Strawberry , Valerian |
| Flavoring purposes | Beer , Chocolate cocoa , Valerian |
| Other purposes | Topnotes |
| Cosmetic purposes | Perfuming agents , Solvents |
Safety Information
Safety information
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
| R 11 - Highly flammable. R 66 - Repeated exposure may cause skin dryness or cracking. S 02 - Keep out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. S 23 - Do not breath vapour. S 25 - Avoid contact with eyes. S 29 - Do not empty into drains. S 33 - Take precautionary measures against static discharge. | |
| 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. | |
| Human Experience: | |
| 2 % solution: no irritation or sensitization. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 1763 mg/kg Industrial Medicine and Surgery. Vol. 41, Pg. 31, 1972. oral-rat LD50 > 13400 mg/kg (Smyth et al., 1962) oral-rabbit LD50 4763 mg/kg Industrial Medicine and Surgery. Vol. 41, Pg. 31, 1972. oral-rat LD50 13400 mg/kg Raw Material Data Handbook, Vol.1: Organic Solvents, 1974. Vol. 1, Pg. 8, 1974. | |
| Dermal Toxicity: | |
| skin-rabbit LD50 > 17400 mg/kg Raw Material Data Handbook, Vol.1: Organic Solvents, 1974. Vol. 1, Pg. 8, 1974. | |
| Inhalation Toxicity: | |
| inhalation-rat LCLo 8000 ppm/4H American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962. | |
Safety in use information
| Category: | |||
| cosmetic, 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 isobutyl acetate usage levels up to: | |||
| 5.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 1200.00 (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 ppm | average maximum ppm | ||
| baked goods: | - | 35.00000 | |
| beverages(nonalcoholic): | - | 11.00000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | 860.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | 5.50000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 16.00000 | |
| fruit ices: | - | 16.00000 | |
| gelatins / puddings: | - | 170.00000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 36.00000 | |
| 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 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 |
| Risk Assessment of Food Contact Materials View page or View pdf |
| EPI System: View |
| NIOSH International Chemical Safety Cards:search |
| NIOSH Pocket Guide:search |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):110-19-0 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :8038 |
| National Institute of Allergy and Infectious Diseases:Data |
| WISER:UN 1213 |
| WGK Germany:1 |
| 2-methylpropyl acetate |
| Chemidplus:0000110190 |
| EPA/NOAA CAMEO:hazardous materials |
| RTECS:110-19-0 |