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| IUPAC name : | (Z)-1,1-dimethoxyhex-3-ene |
| InChI : | InChI=1/C8H16O2/c1-4-5-6-7-8(9-2)10-3/h5-6,8H,4,7H2,1-3H3/b6-5- |
| InChIKey : | AIFDKYGVVMSLMZ-WAYWQWQTBH |
| SMILES : | CC\C=C/CC(OC)OC |
| cas number : | 55444-65-0 |
| molar refractivity : | 42.61 ± 0.3 cm3 |
| parachor : | 374.3 ± 4.0 cm3 |
| index of refraction : | 1.423 ± 0.02 |
| surface tension : | 25.0 ± 3.0 dyne/cm |
| density : | 0.861 ± 0.06 g/cm3 |
| polarizability : | 16.89 ± 0.5 10-24cm3 |
| XlogP : | 2.00 |
| molecular weight : | 144.2114400 |
| formula : | C8 H16 O2 |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
organoleptics :
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| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | fruity apple |
properties :
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| appearence : | colorless clear liquid |
| assay : | 95.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 156.00 to 158.00 °C. @ 760.00 mm Hg
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| flash point : | 89.00 °F. TCC ( 31.67 °C. )
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| logP (o/w) : | 2.07 |
safety :
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| most important hazard(s) : | Xn - Harmful. |
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R 22 - Harmful if swallowed. R 43 - May cause sensitisation by skin contact. S 02 - Keep out of the reach of children. S 20/21 - When using do not eat, drink or smoke. 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 (Z)-3-hexen-1-al dimethyl acetal usage levels up to : |
| | not for fragrance use.
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safety references :
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| EPI System : | view |
| EPA Chem. Sub. Inventory : | Yes |
| WISER : | UN 1993 |
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| WGK Germany : | 2 |
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| | (Z)-1,1-dimethoxyhex-3-ene
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| chemidplus : | 055444650 |
| EPA Substance Registry Services : | 55444-65-0 |
references :
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| | (Z)-1,1-dimethoxyhex-3-ene
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| pubchem : | 686067 |
other :
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