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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | [(6E)-3,7-dimethylnona-1,6-dien-3-yl] acetate |
| InChI : | InChI=1/C13H22O2/c1-6-11(3)9-8-10-13(5,7-2)15-12(4)14/h7,9H,2,6,8,10H2,1,3-5H3/b11-9+ |
| InChIKey : | IVSZEHYDOLAREK-PKNBQFBNBM |
| SMILES : | CC/C(=C/CCC(C)(C=C)OC(=O)C)/C |
| (EINECS) number : | 263-336-9 |
| cas number : | 61931-80-4 |
| beilstein number : | 1779089 |
| molar refractivity : | 63.64 ± 0.3 cm3 |
| parachor : | 541.5 ± 4.0 cm3 |
| index of refraction : | 1.453 ± 0.02 |
| surface tension : | 28.1 ± 3.0 dyne/cm |
| density : | 0.894 ± 0.06 g/cm3 |
| polarizability : | 25.22 ± 0.5 10-24cm3 |
| xlogp : | 3.70 |
| molecular weight : | 210.3125800 |
| formula : | C13 H22 O2 |
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| fda reg : | unspecified |
h. number : | 2915.39.9050 |
| organoleptics : | |
| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | floral bergamot fruity pear |
| substantivity : | 12 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 94.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 246.00 - 247.00 °C. @ 760.00 mm Hg
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| logp : | 4.65 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Oral-Rat >5.00 gm/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
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| flash point ( Deg. F. ) : | 181.00 °F. TCC ( 82.78 °C. )
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| recommendation for ethyl linalyl acetate usage levels up to : |
| | 40.0000 % in the fragrance concentrate.
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| recommendation for ethyl linalyl acetate usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 263-336-9 |
| chemidplus : | 061931804 |
| epa-srs : | 61931-80-4 |
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| other : | |
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| references : | |
| pubchem : | 184179 |
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