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| IUPAC name : | 2,3-diacetoxypropyl octadec-9-enoate |
| InChI : | InChI=1/C25H44O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h11-12,24H,4-10,13-21H2,1-3H3 |
| InChIKey : | KXLSJQTXSAYFDL-VAWYXSNFBG |
| SMILES : | O=C(C)OC(COC(=O)CCCCCCCC=CCCCCCCCC)COC(C)=O |
| cas number : | 28060-90-4 |
| (EINECS) number : | 248-807-9 |
| molar refractivity : | 123.21 ± 0.3 cm3 |
| parachor : | 1085.5 ± 4.0 cm3 |
| index of refraction : | 1.465 ± 0.02 |
| surface tension : | 35.2 ± 3.0 dyne/cm |
| density : | 0.988 ± 0.06 g/cm3 |
| polarizability : | 48.84 ± 0.5 10-24cm3 |
| XlogP : | 7.00 |
| molecular weight : | 440.6132600 (IUPAC) |
| formula : | C25 H44 O6 |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Nanjing : | oleic acid ester with hydroxypropanediyl diacetate
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organoleptics :
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properties :
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| assay : | 95.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 487.00 to 490.00 °C. @ 760.00 mm Hg
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| flash point : | 399.00 °F. TCC ( 203.89 °C. )
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| logP (o/w) : | 7.75 |
safety :
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| most important hazard(s) : | None - None found. |
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S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
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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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safety references :
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| EPI System : | view |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 2 |
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| | 2,3-diacetoxypropyl octadec-9-enoate
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| (EINECS) number : | 248-807-9 |
| chemidplus : | 028060904 |
| EPA Substance Registry Services : | 28060-90-4 |
references :
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| | 2,3-diacetoxypropyl octadec-9-enoate
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| NIST Chemistry WebBook : | 28060904 |
| pubchem : | 204952 |
Cosmetics :
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| Cosmetic uses : |
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other :
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| FDA Everything Added to Food in the United States (EAFUS) | View |