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| IUPAC name : | butyl (Z)-octadec-9-enoate |
| InChI : | InChI=1/C22H42O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-6-4-2/h12-13H,3-11,14-21H2,1-2H3/b13-12- |
| InChIKey : | WIBFFTLQMKKBLZ-SEYXRHQNBK |
| SMILES : | CCCCCCCC/C=C\CCCCCCCC(=O)OCCCC |
| cas number : | 142-77-8 |
| (EINECS) number : | 205-559-6 |
| coe number : | 741 |
| fl. number : | 09.208 |
| molar refractivity : | 105.80 ± 0.3 cm3 |
| parachor : | 919.3 ± 4.0 cm3 |
| index of refraction : | 1.456 ± 0.02 |
| surface tension : | 31.2 ± 3.0 dyne/cm |
| density : | 0.870 ± 0.06 g/cm3 |
| polarizability : | 41.94 ± 0.5 10-24cm3 |
| XlogP : | 8.20 |
| XlogP3-AA : | 8.80 |
| molecular weight : | 338.5676800 (IUPAC) |
| formula : | C22 H42 O2 |
| NMR Predictor : | Predict |
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| export tariff code : | 2916.15.5000 |
| fda reg : | unspecified |
Suppliers :
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| Inoue : | BUTYL OLEATE
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| Pfaltz & Bauer : | Butyl Oleate
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| Sigma-Aldrich-Sigma : | Butyl oleate
practical grade, ~75% |
organoleptics :
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| odor strength : | low |
odor description : at 100.00 %. | mild fatty |
properties :
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| appearence : | pale yellow clear liquid |
| assay : | 75.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 220.00 to 222.00 °C. @ 760.00 mm Hg
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| boiling point : | 228.00 °C. @ 15.00 mm Hg
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| flash point : | > 200.00 °F. TCC ( > 93.33 °C. )
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| logP (o/w) : | 9.75 |
| shelf life : | 12.00 month(s) or longer if stored properly. |
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 butyl oleate usage levels up to : |
| | 10.0000 % in the fragrance concentrate.
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safety references :
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| EPI System : | view |
| NLM Hazardous Substances Data Bank : | search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 1 |
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| | butyl (Z)-octadec-9-enoate
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| (EINECS) number : | 205-559-6 |
| RTECS : | RG3711000 for 142-77-8 |
| chemidplus : | 000142778 |
| EPA Substance Registry Services : | 142-77-8 |
| dtp/nci : | 6700 |
references :
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| | butyl (Z)-octadec-9-enoate
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| fl. number : | 09.208 |
| NIST Chemistry WebBook : | 2767677588 |
| pubchem : | 152050 |
Cosmetics :
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| Cosmetic uses : |
emollients
masking agents
skin conditioning
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other :
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| CosIng : | cosmetic data |