| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | (2-methyl-6-methylideneoct-7-en-2-yl) acetate |
| InChI : | InChI=1/C12H20O2/c1-6-10(2)8-7-9-12(4,5)14-11(3)13/h6H,1-2,7-9H2,3-5H3 |
| InChIKey : | DCXXKSXLKWAZNO-UHFFFAOYAI |
| SMILES : | CC(=O)OC(C)(C)CCCC(=C)C=C |
| (EINECS) number : | 273-868-3 |
| cas number : | 69103-01-1 |
| molar refractivity : | 58.67 ± 0.3 cm3 |
| parachor : | 503.5 ± 4.0 cm3 |
| index of refraction : | 1.445 ± 0.02 |
| surface tension : | 27.3 ± 3.0 dyne/cm |
| density : | 0.891 ± 0.06 g/cm3 |
| polarizability : | 23.26 ± 0.5 10-24cm3 |
| xlogp : | 3.80 |
| molecular weight : | 196.2860000 |
| formula : | C12 H20 O2 |
|
|
| |
| |
| fda reg : | unspecified |
h. number : | 2915.39.9050 |
| organoleptics : | |
| odor type : | citrus |
| odor strength : | medium |
odor description :
at 100.00 %. | fresh herbal bergamot stem floral buchu |
| substantivity : | 12 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.92400 - 0.93800 @ 20.00 °C.
|
| pounds per gallon - calc. : | 7.698 to 7.814
|
| refractive index : | 1.46200 - 1.46600 @ 20.00 °C.
|
| boiling point : | 257.00 - 258.00 °C. @ 760.00 mm Hg
|
| logp : | 3.80 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
|
| Dermal Toxicity(LD50) : |
Not determined
|
| | |
| flash point ( Deg. F. ) : | 195.00 °F. TCC ( 90.56 °C. )
|
| | |
| recommendation for bergamot acetoacetate usage levels up to : |
| | 12.0000 % in the fragrance concentrate.
|
| | |
| safety links : | |
| (EINECS) number : | 273-868-3 |
| chemidplus : | 069103011 |
| epa-srs : | 69103-01-1 |
| | |
| other : | |
| |
|
| references : | |
| pubchem : | 3762333 |
| | |