| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-yl acetate |
| InChI : | InChI=1/C12H20O3/c1-6-12(5)8-7-10(15-12)11(3,4)14-9(2)13/h6,10H,1,7-8H2,2-5H3 |
| InChIKey : | PZMSWQCFPOWCEC-UHFFFAOYAB |
| SMILES : | CC(=O)OC(C)(C)C1CCC(O1)(C)C=C |
| cas number : | 67689-50-3 |
| (EINECS) number : | 266-907-0 |
| molar refractivity : | 60.04 ± 0.3 cm3 |
| parachor : | 506.6 ± 6.0 cm3 |
| index of refraction : | 1.496 ± 0.02 |
| surface tension : | 37.1 ± 3.0 dyne/cm |
| density : | 1.034 ± 0.06 g/cm3 |
| polarizability : | 23.80 ± 0.5 10-24cm3 |
| XlogP : | 2.30 |
| molecular weight : | 212.2854000 |
| formula : | C12 H20 O3 |
| NMR Predictor : | Predict |
|
|
| |
| |
| export tariff code : | 2915.39.9050 |
| fda reg : | unspecified |
organoleptics :
|
| odor strength : | medium |
odor description : at 100.00 %. | warm fruity woody |
properties :
|
| appearence : | colorless clear liquid |
| assay : | 94.00 to 100.00 %
|
| Food Chemicals Codex Listed : | No |
| boiling point : | 251.00 to 252.00 °C. @ 760.00 mm Hg
|
| vapor pressure : | 0.02000 mm/Hg @ 25.00 °C. |
| flash point : | 219.00 °F. TCC ( 103.89 °C. )
|
| logP (o/w) : | 2.10 |
safety :
|
| Oral Toxicity(LD50) : |
| |
Not determined
|
| Dermal Toxicity(LD50) : |
| |
Not determined
|
| Inhalation Toxicity(LC50) : |
| |
Not determined
|
| |
safety in use :
|
| |
| recommendation for linalool oxide acetates usage levels up to : |
| | 6.0000 % in the fragrance concentrate.
|
safety references :
|
| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
| |
| |
| |
| | 2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-yl acetate
|
| (EINECS) number : | 266-907-0 |
| chemidplus : | 067689503 |
| EPA Substance Registry Services : | 67689-50-3 |
references :
|
| | 2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-yl acetate
|
| NIST Chemistry WebBook : | 67689503 |
| pubchem : | 683995 |
other :
|
| VCF-Online: | VCF Volatile Compounds in Food |