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| IUPAC name : | (2E,4E)-octa-2,4-dien-1-ol |
| InChI : | InChI=1/C8H14O/c1-2-3-4-5-6-7-8-9/h4-7,9H,2-3,8H2,1H3/b5-4+,7-6+ |
| InChIKey : | LMBAOEUOOJDUBP-YTXTXJHMBM |
| SMILES : | CCC\C=C\C=C\CO |
| cas number : | 18409-20-6 |
| % from : | 90.00% to 99.90% |
| (EINECS) number : | 242-290-3 |
| fema number : | 3956 |
| jecfa number : | 1180 |
| molar refractivity : | 40.76 ± 0.3 cm3 |
| parachor : | 341.5 ± 4.0 cm3 |
| index of refraction : | 1.472 ± 0.02 |
| surface tension : | 30.5 ± 3.0 dyne/cm |
| density : | 0.868 ± 0.06 g/cm3 |
| polarizability : | 16.15 ± 0.5 10-24cm3 |
| XlogP : | 2.40 |
| molecular weight : | 126.1961600 |
| formula : | C8 H14 O |
| NMR Predictor : | Predict |
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| IUPAC name : | (2E,4Z)-octa-2,4-dien-1-ol |
| InChI : | InChI=1/C8H14O/c1-2-3-4-5-6-7-8-9/h4-7,9H,2-3,8H2,1H3/b5-4-,7-6+ |
| InChIKey : | LMBAOEUOOJDUBP-SCFJQAPRBG |
| SMILES : | CCC\C=C/C=C/CO |
| cas number : | 18409-20-6 (EZ) |
| % from : | 0.10% to 9.00% |
| molar refractivity : | 40.76 ± 0.3 cm3 |
| parachor : | 341.5 ± 4.0 cm3 |
| index of refraction : | 1.472 ± 0.02 |
| surface tension : | 30.5 ± 3.0 dyne/cm |
| density : | 0.868 ± 0.06 g/cm3 |
| polarizability : | 16.15 ± 0.5 10-24cm3 |
| XlogP : | 2.40 |
| molecular weight : | 126.1961600 |
| formula : | C8 H14 O |
| NMR Predictor : | Predict |
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| export tariff code : | 2905.29.9000 |
| fda reg : | unspecified |
Suppliers :
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| Penta : | trans-2,trans-4-octadienol
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organoleptics :
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| odor type : | fatty |
| odor strength : | medium |
odor description : at 100.00 %. | mild fatty chicken fat creamy waxy |
properties :
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| appearence : | colorless clear liquid |
| assay : | 95.00 to 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.86400 to 0.87400 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.189 to 7.273
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| refractive index : | 1.48600 to 1.49600 @ 20.00 °C.
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| boiling point : | 75.00 °C. @ 0.50 mm Hg
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| boiling point : | 198.00 to 199.00 °C. @ 760.00 mm Hg
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| flash point : | 185.00 °F. TCC ( 85.00 °C. )
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| logP (o/w) : | 2.30 |
safety :
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| most important hazard(s) : | Xi - Irritant |
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R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. 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 36 - Wear suitable protective clothing.
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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 2,4-octadien-1-ol usage levels up to : |
| | not for fragrance use.
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| recommendation for 2,4-octadien-1-ol usage levels up to : |
| | 5.0000 ppm in the flavor.
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safety references :
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| EPI System : | view |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 3 |
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| | (2E,4E)-octa-2,4-dien-1-ol
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| (EINECS) number : | 242-290-3 |
| chemidplus : | 018409206 |
| EPA Substance Registry Services : | 18409-20-6 |
| | (2E,4Z)-octa-2,4-dien-1-ol
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references :
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| | (2E,4E)-octa-2,4-dien-1-ol
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| jecfa number : | 1180 |
| pubchem : | 664457 |
| | (2E,4Z)-octa-2,4-dien-1-ol
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other :
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| VCF-Online: | VCF Volatile Compounds in Food |