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linalool oxide
General Material Information
| Preferred name | linalool oxide |
| Trivial Name | Linalool, oxide |
| Short Description | cis- and trans-linalool oxide |
| Formula | C10 H18 O2 |
| CAS Number | 1365-19-1 |
| Deleted CAS Number | 11063-76-6 |
| FEMA Number | 3746 |
| ECHA Number | 215-723-9 |
| FDA UNII | 4UJJ55KMCS |
| Nikkaji Number | J354.663B |
| COE Number | 11876 |
| xLogP3-AA | 1.80 (est) |
| NMR Predictor | External link |
| JECFA Food Flavoring | 1454 cis- and trans-linalool oxide |
| FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
| 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-(5-methyl-5-vinyltetrahydro-2-furanyl)-2-propanol | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 1365-19-1 |
| Pubchem (cid): | 102611 |
| Pubchem (sid): | 135059203 |
| Flavornet: | 1365-19-1 |
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 |
| HMDB (The Human Metabolome Database): | HMDB35365 |
| FooDB: | FDB021839 |
| Export Tariff Code: | 2932.19.0000 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| EFSA Update of results on the monitoring of furan levels in food: | Read Report |
| EFSA Previous report: Results on the monitoring of furan levels in food: | Read Report |
| EFSA Report of the CONTAM Panel on provisional findings on furan in food: | Read Report |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 170.25186157227 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 7.755 to 7.838 |
| Refractive Index | 1.451 to 1.456 @ 20 °C |
| Vapor Pressure | 0.002 mmHg @ 25 °C |
| Flash Point TCC Value | 62.78 °C TCC |
| logP (o/w) | 1.375 est |
| Shelf life | 24 months (or longer if stored properly.) |
| Storage notes | Store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Solubility | |
| alcohol | Yes |
| water, 1669 mg/L @ 25 °C (est) | Yes |
| water | No |
| Stability | |
| detergent | Unspecified |
| soap | Unspecified |
Organoleptic Properties
| Odor Type: Floral | |
| floral, herbal, earthy, green, woody, cooling, terpenic | |
| Odor strength | medium |
| Substantivity | 12 hour(s) at 100.00 % |
| Luebke, William tgsc, (2003) | At 100.00 %. floral herbal earthy green |
| Mosciano, Gerard P&F 22, No. 3, 47, (1997) | Woody, floral, cooling, terpy and slightly green |
| Flavor Type: Green | |
| green, floral, fatty, woody, fermented, herbal, fruity, berry | |
| Mosciano, Gerard P&F 22, No. 3, 47, (1997) | At 50.00 ppm. Green, floral, fatty, woody, fermented, herbal, fruity and berry |
| General comment | Floreal, fruity |
Occurrences
| (data available) |
Potential Uses
| Applications | |
| Odor purposes | Apricot , Blackberry , Bois de rose , Carrot seed , Champaca , Cinnamon , Cistus , Clary sage oil replacer , Coffee , Currant , Fern , Geranium , Grapefruit , Guava , Hop , Jasmin , Lavandin , Lavender , Lemongrass , Lychee , Marjoram , Melissa oil replacer , Mint , Narcissus , Neroli , Orange , Osmanthus , Passion fruit , Patchouli , Pepper black pepper , Peppermint , Petitgrain , Pineapple , Rose , Strawberry , Tagete oil replacer , Tangerine , Tea green tea , Tomato leaf , Verbena , Wine , Wormwood oil replacer |
| Flavoring purposes | Carrot seed , Chocolate cocoa , Cistus , Brandy grape brandy , Marjoram , Pepper black pepper , Brandy plum brandy , Rice , Tea black tea , Tea herbal tea , Wasabi |
| Other purposes | Timber , Topnotes , Truffle |
| Cosmetic purposes | Perfuming agents |
Safety Information
Safety information
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xn - Harmful. | |
| R 22 - Harmful if swallowed. R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 20/21 - When using do not eat, drink or smoke. 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 37/39 - Wear suitable gloves and eye/face protection. | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| Acute toxicity, Oral (Category 4), H302 | |
| GHS Label elements, including precautionary statements | |
| Pictogram |  |
| Signal word | Warning |
| Hazard statement(s) | |
| H302 - Harmful if swallowed H313 - May be harmful in contact with skin H314 - Causes severe skin burns and eye damage | |
| Precautionary statement(s) | |
| P264 - Wash skin thouroughly after handling. P270 - Do not eat, drink or smoke when using this product. P280 - Wear protective gloves/protective clothing/eye protection/face protection. P301 + P312 - IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P305 + P351 + P338 - IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P310 - Immediately call a POISON CENTER or doctor/physician. P330 - Rinse mouth. P501 - Dispose of contents/ container to an approved waste disposal plant. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 1150 mg/kg (Moreno, 1977acr) oral-rat LD50 [sex: M,F] 2210 mg/kg (Colaianni, 1967) | |
| Dermal Toxicity: | |
| skin-rabbit LD50 2500 mg/kg (Reagan & Becci, 1984j) | |
| 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 linalool oxide usage levels up to: | |||
| 5.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 72.50 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 14.00 (μg/capita/day) | ||
| Structure Class: | II | ||
| 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: 14 | |||
| Click here to view publication 14 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 11.25000 | |
| beverages(nonalcoholic): | - | 3.86000 | |
| beverages(alcoholic): | - | 6.75000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 7.00000 | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | 4.61000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | - | |
| 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: | - | 10.17800 | |
| 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 33 (FGE.33)[1] - Six Tetrahydrofuran Derivatives from Chemical Groups 13, 14, 16 and 26 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
| Flavouring Group Evaluation 75 (FGE.75)[1] - Consideration of tetrahydrofuran derivatives and a furanone derivative evaluated by JECFA (63rd meeting) structurally related to tetrahydrofuran derivatives evaluated by EFSA in FGE.33 (2008) View page or View pdf |
| Scientific Opinion on the safety and efficacy of furanones and tetrahydrofurfuryl derivatives: 4-hydroxy-2,5-dimethylfuran-3(2H)-one, 4,5-dihydro-2-methylfuran-3(2H)-one, 4-acetoxy-2,5-dimethylfuran-3(2H)-one and linalool oxide (chemical group 13) when used as flavourings for all animal species View page or View pdf |
| Scientific Opinion on the safety and efficacy of furanones and tetrahydrofurfuryl derivatives: 5-ethyl-3-hydroxy-4-methylfuran-2(5H)-one and 3-hydroxy-4,5-dimethylfuran-2(5H)-one (chemical group 13) when used as flavourings for all animal species View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 75, Revision 1 (FGE.75Rev1): Consideration of tetrahydrofuran derivatives evaluated by JECFA (63rd meeting) structurally related to tetrahydrofuran derivatives evaluated by EFSA in FGE.33 (2008) View page or View pdf |
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):1365-19-1 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :102611 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 2-(5-methyl-5-vinyltetrahydro-2-furanyl)-2-propanol |
| Chemidplus:0001365191 |
| RTECS:OI7782000 for cas# 1365-19-1 |