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| IUPAC name : | 8-(1-methoxyethoxy)-2,6-dimethyloct-2-ene |
| InChI : | InChI=1/C13H26O2/c1-11(2)7-6-8-12(3)9-10-15-13(4)14-5/h7,12-13H,6,8-10H2,1-5H3 |
| InChIKey : | YSABATHBMSLQLP-UHFFFAOYAE |
| SMILES : | CC(CCC=C(C)C)CCOC(C)OC |
| cas number : | 68039-24-7 |
| (EINECS) number : | 268-243-7 |
| molar refractivity : | 65.58 ± 0.3 cm3 |
| parachor : | 566.8 ± 4.0 cm3 |
| index of refraction : | 1.437 ± 0.02 |
| surface tension : | 26.4 ± 3.0 dyne/cm |
| density : | 0.857 ± 0.06 g/cm3 |
| polarizability : | 25.99 ± 0.5 10-24cm3 |
| XlogP : | 4.20 |
| XlogP3-AA : | 4.10 |
| molecular weight : | 214.3443400 (IUPAC) |
| formula : | C13 H26 O2 |
| NMR Predictor : | Predict |
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| export tariff code : | 2911.00.5000 |
| fda reg : | unspecified |
Suppliers :
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| Nanjing : | 2-octene,8-(1-methoxyethoxy)-2,6-dimethyl-
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organoleptics :
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| odor type : | citrus |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | citrus natural lemon |
| odor sample from : | International Flavors & Fragrances Inc. |
| substantivity : | 192 Hour(s) |
properties :
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| appearence : | colorless clear liquid |
| assay : | 75.00 to 80.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.86100 to 0.86900 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.164 to 7.231
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| specific gravity : | 0.86200 to 0.87000 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.181 to 7.248
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| refractive index : | 1.43800 to 1.44400 @ 20.00 °C.
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| flash point : | > 212.00 °F. TCC ( > 100.00 °C. )
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| logP (o/w) : | 4.18 |
safety :
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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 acetaldehyde citronellyl methyl acetal usage levels up to : |
| | 10.0000 % in the fragrance concentrate.
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| recommendation for acetaldehyde citronellyl methyl acetal 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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| | 8-(1-methoxyethoxy)-2,6-dimethyloct-2-ene
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| (EINECS) number : | 268-243-7 |
| chemidplus : | 068039247 |
| EPA Substance Registry Services : | 68039-24-7 |
references :
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| | 8-(1-methoxyethoxy)-2,6-dimethyloct-2-ene
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| NIST Chemistry WebBook : | 68039247 |
| pubchem : | 684258 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |