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| IUPAC name : | 1,5,5-trimethylbicyclo[2.2.1]heptan-6-ol |
| InChI : | InChI=1/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3 |
| InChIKey : | IAIHUHQCLTYTSF-UHFFFAOYAX |
| SMILES : | CC1(C2CCC(C2)(C1O)C)C |
| cas number : | 1632-73-1 |
| (EINECS) number : | 216-639-5 |
| fema number : | 2480 |
| coe number : | 87 |
| jecfa number : | 1397 |
| fl. number : | 02.038 |
| molar refractivity : | 45.85 ± 0.3 cm3 |
| parachor : | 381.2 ± 4.0 cm3 |
| index of refraction : | 1.502 ± 0.02 |
| surface tension : | 36.2 ± 3.0 dyne/cm |
| density : | 0.992 ± 0.06 g/cm3 |
| polarizability : | 18.17 ± 0.5 10-24cm3 |
| XlogP : | 2.30 |
| molecular weight : | 154.2493200 (IUPAC) |
| formula : | C10 H18 O |
| pherobase floral: | view |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | 172.515 |
Suppliers :
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| Advanced Biotech : | fenchyl alcohol
98% min. natural Odor: Camphor |
| Berje : | alpha-Fenchyl Alcohol
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| Citrus and Allied Essences : | alpha-Fenchyl Alcohol
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| Inoue : | FENCHYL ALCOHOL
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| John D. Walsh : | alpha-Fenchyl Alcohol
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| Moellhausen : | fenchol
95% min. nature identical kosher Odor: camphoraceous, conifers Flavor: fresh, pine |
| Penta : | alpha-fenchyl alcohol
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| SAFC Global® : | (1R)-(+)-Fenchyl alcohol
≥97%, Kosher Odor: grape; lemon; lime; musty; oily; herbaceous; raspberry; minty; earthy; pepper; camphoraceous; spicy; wine-like |
| Takasago : | alpha-Fenchyl Alcohol
≥97% Odor: Powerful and diffusive, Camphor-like Widely used in perfumery. Blends very well with lemon-lime notes. Gives power and lift to floral fragrances. Used in mushroom applications for earthy top notes. |
organoleptics :
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| odor type : | balsamic |
| odor strength : | medium |
odor description: at 100.00 %. | camphor borneol pine woody dry sweet lemon Luebke, William tgsc, (1989) |
| odor sample from : | CA Aromatics Company Inc. |
| substantivity : | 12 Hour(s) |
properties :
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| appearence : | pale yellow solid |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 35.00 to 40.00 °C. @ 760.00 mm Hg
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| boiling point : | 201.00 to 202.00 °C. @ 760.00 mm Hg
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| boiling point : | 122.00 to 123.00 °C. @ 50.00 mm Hg
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| vapor pressure : | 0.10000 mm/Hg @ 20.00 °C. |
| flash point : | 165.00 °F. TCC ( 73.89 °C. )
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| logP (o/w) : | 2.85 |
safety :
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| most important hazard(s) : | Xi - Irritant |
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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.
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| Human experience : | 4 % solution: no irritation or sensitization. |
| Oral Toxicity(LD50) : | |
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Not determined
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| Dermal Toxicity(LD50) : | |
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Not determined
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| Inhalation Toxicity(LC50) : | |
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Not determined
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safety in use :
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| Category : | flavor and fragrance agents |
| Maximised Survey-derived Daily Intakes (MSDI-EU) : | 55.00 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) : | 17.00 (μg/capita/day) |
| Structure Class : | I |
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| maximum skin levels for fine fragrances : |
| | 0.0600 % and are based on the assumption that the fragrance mixture is used at 20% in a consumer product (IFRA Use Level Survey). (IFRA, 2004)
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| recommendation for fenchol fragrance usage levels up to : |
| | 4.0000 % in the fragrance concentrate.
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| use level in formulae for use in cosmetics : |
| | 0.0500 %
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| dermal systemic exposure in cosmetic products : |
| | 0.0013 mg/kg/day (IFRA, 2004)
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| recommendation for fenchol flavor usage levels up to : |
| | 5.0000 ppm in the flavor.
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safety references :
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| European Food Safety Athority(efsa) : | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
| WISER : | UN 1325 |
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| WGK Germany : | 2 |
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| | 1,5,5-trimethylbicyclo[2.2.1]heptan-6-ol |
| (EINECS) number : | 216-639-5 |
| chemidplus : | 001632731 |
| EPA Substance Registry Services : | 1632-73-1 |
references :
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| | 1,5,5-trimethylbicyclo[2.2.1]heptan-6-ol |
| fl. number : | 02.038 |
| jecfa number : | 1397 |
| NIST Chemistry WebBook : | 1472205056 |
| pubchem : | 158728 |
| Flavornet : | 1632-73-1 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |
| VCF-Online: | VCF Volatile Compounds in Food |
| FDA Everything Added to Food in the United States (EAFUS) | View |