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| IUPAC name : | (E)-5-methyl-2-propan-2-ylhex-2-en-1-ol |
| InChI : | InChI=1/C10H20O/c1-8(2)5-6-10(7-11)9(3)4/h6,8-9,11H,5,7H2,1-4H3/b10-6- |
| InChIKey : | VUGJPGPMYGKRPW-POHAHGREBS |
| SMILES : | CC(C)C\C=C(\CO)/C(C)C |
| cas number : | 40853-53-0 |
| (EINECS) number : | 255-111-9 |
| beilstein number : | 1747799 |
| molar refractivity : | 49.73 ± 0.3 cm3 |
| parachor : | 424.8 ± 4.0 cm3 |
| index of refraction : | 1.449 ± 0.02 |
| surface tension : | 27.6 ± 3.0 dyne/cm |
| density : | 0.843 ± 0.06 g/cm3 |
| polarizability : | 19.71 ± 0.5 10-24cm3 |
| XlogP : | 3.00 |
| molecular weight : | 156.2652000 (IUPAC) |
| formula : | C10 H20 O |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
organoleptics :
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| odor type : | herbal |
| odor strength : | medium |
odor description: at 100.00 %. | fresh herbal mint rosemary woody Luebke, William tgsc, (1988) |
| odor sample from : | Fritzsche Dodge & Olcott, Inc. |
| substantivity : | 8 Hour(s) |
properties :
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| appearence : | colorless clear liquid |
| assay : | 98.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 200.00 to 201.00 °C. @ 760.00 mm Hg
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| flash point : | 178.00 °F. TCC ( 81.11 °C. )
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| logP (o/w) : | 3.53 |
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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| 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 : | information only not used for fragrances or flavors |
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| recommendation for isodihydrolavandulol fragrance usage levels up to : |
| | not for fragrance use.
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| recommendation for isodihydrolavandulol flavor usage levels up to : |
| | not for flavor use.
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safety references :
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| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 2 |
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| | (E)-5-methyl-2-propan-2-ylhex-2-en-1-ol |
| (EINECS) number : | 255-111-9 |
| chemidplus : | 040853530 |
| EPA Substance Registry Services : | 40853-53-0 |
references :
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| | (E)-5-methyl-2-propan-2-ylhex-2-en-1-ol |
| pubchem : | 179857 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |