Articles:
2-furanmethanol, 5-ethenyltetrahydro-a,a,5-trimethyl-, trans-
Notes:
This is the trans form of furanoid linalool oxide, also called 'Linalool oxide A' or 'Linalool oxide II'; there are 2 possible stereo-isomers.
| CAS Number: | 34995-77-2 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 252-312-3 | |
| FDA UNII: | 986J3104O2 | |
| Nikkaji Web: | J239.309C | |
| XlogP3-AA: | 1.40 (est) | |
| Molecular Weight: | 170.25186000 | |
| Formula: | C10 H18 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 |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 90.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 201.00 to 202.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.021000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 141.00 °F. TCC ( 60.56 °C. ) |
| logP (o/w): | 1.557 (est) |
| Soluble in: | |
| alcohol | |
| water, 1669 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Strength: | medium |
| Odor Description: at 100.00 %. | floral |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| None found |
Safety Information:
| 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) | |
| 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 | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for (E)-linalool oxide (furanoid) usage levels up to: | |||
| 2.0000 % in the fragrance concentrate. | |||
Safety References:
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 34995-77-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 6432254 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| 2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-2-ol | |
| Chemidplus: | 0034995772 |
References:
| Leffingwell: | Chirality or Article |
| 2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-2-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 34995-77-2 |
| Pubchem (cid): | 6432254 |
| Pubchem (sid): | 135075522 |
| Flavornet: | 34995-77-2 |
| 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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB40727 |
| FooDB: | FDB020535 |
| YMDB (Yeast Metabolome Database): | YMDB01678 |
| 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 |
Potential Blenders and core components note
Potential Uses:
| apricot | FR | |
| blackberry | FR | |
| bois de rose | FR | |
| carrot seed | FL/FR | |
| champaca | FR | |
| chocolate cocoa | FL | |
| cinnamon | FR | |
| cistus | FL/FR | |
| clary sage oil replacer | FR | |
| coffee | FR | |
| currant | FR | |
| fern | FR | |
| floral | FR | |
| geranium | FR | |
| brandy grape brandy | FL | |
| grapefruit | FR | |
| guava | FR | |
| herbal | FR | |
| hop | FR | |
| jasmin | FR | |
| lavandin | FR | |
| lavender | FR | |
| lemongrass | FR | |
| lychee | FR | |
| marjoram | FL/FR | |
| melissa oil replacer | FR | |
| mint | FR | |
| narcissus | FR | |
| neroli | FR | |
| orange | FR | |
| osmanthus | FR | |
| passion fruit | FR | |
| patchouli | FR | |
| pepper black pepper | FL/FR | |
| peppermint | FR | |
| petitgrain | FR | |
| pineapple | FR | |
| brandy plum brandy | FL | |
| rice | FL | |
| rose | FR | |
| strawberry | FR | |
| tagete oil replacer | FR | |
| tangerine | FR | |
| tea black tea | FL | |
| tea green tea | FR | |
| tea herbal tea | FL | |
| timber | ||
| tomato leaf | FR | |
| topnotes | ||
| truffle | ||
| verbena | FR | |
| wasabi | FL | |
| wine | FR | |
| woody | FR | |
| wormwood oil replacer | FR |
Occurrence (nature, food, other): note
| allamanda cathartica linn. flower oil brazil @ 0.60% Data GC Search Trop Picture | |
| basil oil Search Trop Picture | |
| bois de rose leaf oil brazil @ 1.00-1.54% Data GC Search Trop Picture | |
| bois de rose oil brazil @ 0.90-1.60% Data GC Search Trop Picture | |
| carrot seed oil spain @ 0.05-0.13% Data GC Search Trop Picture | |
| champaca concrete @ 0.78% Data GC Search Trop Picture | |
| cinnamon ceylon cinnamon bark Search Trop Picture | |
| cinnamon ceylon cinnamon leaf Search Trop Picture | |
| cinnamon ceylon cinnamon root bark Search Trop Picture | |
| cistus oil @ 0.4% Data GC Search Trop Picture | |
| clary sage oil france @ trace% Data GC Search Trop Picture | |
| clary sage oil greece @ 1.10% Data GC Search Trop Picture | |
| clary sage oil sardinia @ 0.40% Data GC Search Trop Picture | |
| clary sage oil spain @ trace% Data GC Search Trop Picture | |
| croton cajucara benth. leaf oil brazil @ trace% Data GC Search Trop Picture | |
| croton flavens l. (welensali) leaf oil curacao @ trace% Data GC Search Trop Picture | |
| dialium guineense wild.fruit oil france @ 1.10% Data GC Search Trop Picture | |
| elder black elder flower oil Search Trop Picture | |
| eschweilera coriacea (a. p. dc.) mori flower oil brazil @ 1.20% Data GC Search Trop Picture | |
| geranium leaf oil india @ 0.26% Data GC Search Trop Picture | |
| geranium petiole oil india @ 0.07% Data GC Search Trop Picture | |
| geranium stem oil india @ 0.98% Data GC Search Trop Picture | |
| ginger rhizome oil Search Trop Picture | |
| ginkgo biloba oil Search Trop Picture | |
| ginkgo biloba wood Search Trop Picture | |
| glycosmis pentaphylla (cor.) seed oil india @ 0.60% Data GC Search Trop Picture | |
| grapefruit oil c.p. @ 0.21% Data GC Search Trop Picture | |
| grapefruit oil c.p. @ 0.23% Data GC Search Trop Picture | |
| guava leaf oil cuba @ trace% Data GC Search Trop Picture | |
| kewda oil @ 0.12-0.13% Data GC Search Trop Picture | |
| laurel leaf oil turkey @ <0.10% Data GC Search Trop Picture | |
| lavandin oil abrialis @ 0.11% Data GC Search Trop Picture | |
| lavandin oil grosso @ 0.16% Data GC Search Trop Picture | |
| lavender flower oil lithuania @ 1.98% Data GC Search Trop Picture | |
| lavender oil france @ 1.98% Data GC Search Trop Picture | |
| lavender oil greece @ 0.06% Data GC Search Trop Picture | |
| lavender stem oil lithuania @ 1.49% Data GC Search Trop Picture | |
| layana oil kenya @ trace% Data GC Search Trop Picture | |
| lemon verbena oil morocco @ 0.1% Data GC Search Trop Picture | |
| lemongrass oil morocco @ 0.10% Data GC Search Trop Picture | |
| lychee canned lychee Search Trop Picture | |
| michelia champaca flower absolute @ 0.10% Data GC Search Trop Picture | |
| narcissus absolute @ 0.06% Data GC Search Trop Picture | |
| neroli bigarde oil france @ 0.15% Data GC Search Trop Picture | |
| orange bigarade oil @ 1.02% Data GC Search Picture | |
| orange peel oil bitter china @ 0.16% Data GC Search Trop Picture | |
| orange peel oil bitter italy @ 0.05% Data GC Search Trop Picture | |
| oregano plant Search Trop Picture | |
| osmanthus absolute @ 14.60% Data GC Search Trop Picture | |
| papaya fruit Search Trop Picture | |
| pepper oil black india @ 0.60% Data GC Search Trop Picture | |
| petitgrain combava oil @ trace% Data GC Search Picture | |
| petitgrain sweet oil @ 0.89% Data GC Search Picture | |
| pimenta racemosa leaf oil lemon @ 0.07% Data GC Search Trop Picture | |
| tarragon shoot oil Search Trop Picture | |
| tea leaf Search Trop Picture | |
| tea leaf oil Search Trop Picture | |
| tea shoot Search Trop Picture |
Synonyms:
| epoxydihydrolinalool I | |
| 2-[(2S,5S)-5- | ethenyl-5-methyloxolan-2-yl]propan-2-ol |
| 2-[(2S,5S)-5- | ethenyl-5-methyltetrahydrofuran-2-yl]propan-2-ol |
| trans-5- | ethenyltetrahydro-a,a,5-trimethyl-2-furanmethanol |
| 2- | furanmethanol, 5-ethenyltetrahydro-a,a,5-trimethyl-, (2S,5S)- |
| 2- | furanmethanol, 5-ethenyltetrahydro-a,a,5-trimethyl-, trans- |
| (E)- | furanoid linalool oxide |
| (E)- | linalool 3,6-oxide |
| trans- | linalool 3,6-oxide |
| (E)- | linalool oxide (furanoid) |
| trans- | linalool oxide (furanoid) |
| linalool oxide 2 | |
| (E)- | linalool oxide A |
| trans- | linalool oxide A |
| linalool oxide II | |
| linalool oxide trans | |
| (E)-2- | methyl-2-vinyl-5-(1-hydroxy-1-methyl ethyl) tetrahydrofuran |
| trans-2- | methyl-2-vinyl-5-(1-hydroxy-1-methyl ethyl) tetrahydrofuran |
| trans-2- | methyl-2-vinyl-5-(1-hydroxy-1-methylethyl)tetrahydrofuran |
| 2-[(2S,5S)-5- | methyl-5-vinyltetrahydrofuran-2-yl]propan-2-ol |
| tetrahydro-alpha,alpha,5-trimethyl-5-vinyl furan-2-methanol | |
| (E)-alpha,alpha,5- | trimethyl-5-vinyl tetrahydrofurfuryl alcohol |
| trans-alpha,alpha,5- | trimethyl-5-vinyl tetrahydrofurfuryl alcohol |
| (E)-2- | vinyl-2-methyl-5-(1-hydroxy-1-methyl ethyl) tetrahydrofuran |
| trans-2- | vinyl-2-methyl-5-(1-hydroxy-1-methyl ethyl) tetrahydrofuran |
| trans-2- | vinyl-2-methyl-5-(1-hydroxy-1-methylethyl)tetrahydrofuran |