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| IUPAC name : | (E)-3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol |
| InChI : | InChI=1/C15H26O/c1-11-7-8-13(15(11,5)6)9-10-14(3,4)12(2)16/h7,9-10,12-13,16H,8H2,1-6H3/b10-9+ |
| InChIKey : | QZFSNJAQFWEXEA-MDZDMXLPBW |
| SMILES : | CC1=CCC(C1(C)C)\C=C\C(C)(C)C(C)O |
| cas number : | 107898-54-4 |
| molar refractivity : | 72.42 ± 0.3 cm3 |
| parachor : | 578.2 ± 6.0 cm3 |
| index of refraction : | 1.519 ± 0.02 |
| surface tension : | 34.7 ± 3.0 dyne/cm |
| density : | 0.933 ± 0.06 g/cm3 |
| polarizability : | 28.71 ± 0.5 10-24cm3 |
| molecular weight : | 222.3663400 (IUPAC) |
| formula : | C15 H26 O |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Firmenich : | POLYSANTOL®
≥95% Odor: A rich and diffusive sandalwood note of superb quality and enormous strength. |
| Moellhausen : | polysantol
95% min. nature identical kosher Odor: powerful sandalwood-character |
| Organica Aromatics : | SUPERSANTOL
NLT 90%(sum of isomers) |
| Penta : | polysantol
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| Vigon : | Polysantol
Odor: WOODY |
organoleptics :
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| odor type : | woody |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description :¹ at 10.00 % in dipropylene glycol. | woody sandalwood herbal tropical |
| odor sample from : | Firmenich & Company Inc. |
| substantivity : | 336 hour(s) at 100.00 % |
properties :
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| appearence : | colorless clear liquid |
| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 0.89800 to 0.90600 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.481 to 7.548
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| refractive index : | 1.48000 to 1.48400 @ 20.00 °C.
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| boiling point : | 298.00 to 299.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| flash point : | > 212.00 °F. TCC ( > 100.00 °C. )
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| logP (o/w) : | 4.78 |
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 37/39 - Wear suitable gloves and eye/face protection.
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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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| recommendation for santol pentenol usage levels up to : |
| | 4.0000 % in the fragrance concentrate.
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| recommendation for santol pentenol 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 : | 1 |
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| | (E)-3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol
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| chemidplus : | 107898544 |
| EPA Substance Registry Services : | 107898-54-4 |
references :
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| | (E)-3,3-dimethyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-4-penten-2-ol
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| pubchem : | 37413055 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| reference : | Luebke, William tgsc, (1997)¹ |
| CosIng : | cosmetic data |