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| IUPAC name : | 3-methyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)pentan-2-ol |
| InChI : | InChI=1/C14H26O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h7,10,12-13,15H,6,8-9H2,1-5H3 |
| InChIKey : | NGYMOTOXXHCHOC-UHFFFAOYAJ |
| SMILES : | CC1=CCC(C1(C)C)CCC(C)C(C)O |
| cas number : | 65113-99-7 |
| (EINECS) number : | 265-453-0 |
| molar refractivity : | 65.99 ± 0.3 cm3 |
| parachor : | 552.2 ± 6.0 cm3 |
| index of refraction : | 1.461 ± 0.02 |
| surface tension : | 27.9 ± 3.0 dyne/cm |
| density : | 0.875 ± 0.06 g/cm3 |
| polarizability : | 26.16 ± 0.5 10-24cm3 |
| XlogP : | 4.50 |
| molecular weight : | 210.3556400 (IUPAC) |
| formula : | C14 H26 O |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Berje : | Sandasweet
(Sandalore®Type) |
| Givaudan : | Sandalore®
Odor: Sandalwood, Warm, Sweet |
| Moellhausen : | sandalorex
88% min. artifical kosher Odor: WARM, SWEET, SANDALWOOD |
| Penta : | sandalore
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| Vigon : | Sandalore
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organoleptics :
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| odor type : | woody |
| odor strength : | medium |
odor description :¹ at 100.00 %. | sweet sandalwood amyris woody |
| odor sample from : | Givaudan Corporation |
| substantivity : | 400 Hour(s) |
properties :
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| appearence : | pale yellow clear viscous liquid |
| assay : | 90.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.90000 @ 25.00 °C.
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| refractive index : | 1.47200 @ 20.00 °C.
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| boiling point : | 95.00 to 98.00 °C. @ 0.50 mm Hg
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| vapor pressure : | 0.00130 mm/Hg @ 20.00 °C. |
| flash point : | > 212.00 °F. TCC ( > 100.00 °C. )
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| logP (o/w) : | 4.73 |
safety :
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| most important hazard(s) : | Xi - Irritant |
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R 36/37/38 - Irritating to eyes, respiratory system, and skin. 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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Oral-Rat 6700.00 mg/kg
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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 sandal pentanol usage levels up to : |
| | 10.0000 % in the fragrance concentrate.
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| recommendation for sandal pentanol 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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| | 3-methyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)pentan-2-ol
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| (EINECS) number : | 265-453-0 |
| chemidplus : | 065113997 |
| EPA Substance Registry Services : | 65113-99-7 |
references :
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| | 3-methyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)pentan-2-ol
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| pubchem : | 680702 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| reference : | Luebke, William tgsc, (1987)¹ |
| CosIng : | cosmetic data |