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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | [(2E)-3,7-dimethylocta-2,6-dienyl] nonanoate |
| InChI : | InChI=1/C19H34O2/c1-5-6-7-8-9-10-14-19(20)21-16-15-18(4)13-11-12-17(2)3/h12,15H,5-11,13-14,16H2,1-4H3/b18-15+ |
| InChIKey : | WVOMTKJRDMPOCF-OBGWFSINBI |
| SMILES : | CCCCCCCCC(=O)OC\C=C(/C)\CCC=C(C)C |
| cas number : | 68039-29-2 |
| (EINECS) number : | 268-247-9 |
| molar refractivity : | 91.64 ± 0.3 cm3 |
| parachor : | 779.5 ± 4.0 cm3 |
| index of refraction : | 1.463 ± 0.02 |
| surface tension : | 30.2 ± 3.0 dyne/cm |
| density : | 0.885 ± 0.06 g/cm3 |
| polarizability : | 36.33 ± 0.5 10-24cm3 |
| XlogP : | 5.50 |
| molecular weight : | 294.4720600 |
| formula : | C19 H34 O2 |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
organoleptics :
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| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | bourbon geranium |
properties :
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| appearence : | colorless clear liquid |
| assay : | 98.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.88200 @ 25.00 °C.
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| boiling point : | 378.00 to 379.00 °C. @ 760.00 mm Hg
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| flash point : | 214.00 °F. TCC ( 101.11 °C. )
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| logP (o/w) : | 7.82 |
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 geranyl nonanoate usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| recommendation for geranyl nonanoate 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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| | [(2E)-3,7-dimethylocta-2,6-dienyl] nonanoate
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| (EINECS) number : | 268-247-9 |
| chemidplus : | 068039292 |
| EPA Substance Registry Services : | 68039-29-2 |
references :
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| | [(2E)-3,7-dimethylocta-2,6-dienyl] nonanoate
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| pubchem : | 683697 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |