| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | prop-2-enyl nonanoate |
| InChI : | InChI=1/C12H22O2/c1-3-5-6-7-8-9-10-12(13)14-11-4-2/h4H,2-3,5-11H2,1H3 |
| InChIKey : | MFLWLDDOGSNSKO-UHFFFAOYAJ |
| SMILES : | CCCCCCCCC(=O)OCC=C |
| (EINECS) number : | 231-334-7 |
| cas number : | 7493-72-3 |
| fema number : | 2036 |
| coe number : | 390 |
| jecfa number : | 6 |
| fl. number : | 09.109 |
| molar refractivity : | 59.14 ± 0.3 cm3 |
| parachor : | 523.3 ± 4.0 cm3 |
| index of refraction : | 1.438 ± 0.02 |
| surface tension : | 29.1 ± 3.0 dyne/cm |
| density : | 0.880 ± 0.06 g/cm3 |
| polarizability : | 23.44 ± 0.5 10-24cm3 |
| xlogp : | 4.50 |
| molecular weight : | 198.3018800 |
| formula : | C12 H22 O2 |
| BioActivity Analysis : | 17389193 |
|
|
| |
| |
| fda reg : | 172.515 |
h. number : | unspecified |
| organoleptics : | |
| odor type : | waxy |
| odor strength : | medium |
odor description :
at 100.00 %. | sweet waxy fruity wine creamy vinous pineapple |
| taste description³ : | at 10.00 ppm.
Waxy, slightly green with a creamy berry and fruity nuance |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 97.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.87800 @ 20.00 °C.
|
| refractive index : | 1.43000 @ 20.00 °C.
|
| boiling point : | 151.00 °C. @ 50.00 mm Hg
|
| boiling point : | 87.00 - 91.00 °C. @ 3.00 mm Hg
|
| logp : | 4.71 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
| | |
| Oral Toxicity(LD50) : |
Not determined
|
| Dermal Toxicity(LD50) : |
Not determined
|
| | |
| flash point ( Deg. F. ) : | 192.00 °F. TCC ( 88.89 °C. )
|
| | |
| IFRA purity specification : | < 0.1% free allyl alcohol |
| recommendation for allyl nonanoate usage levels up to : |
| | 4.0000 % in the fragrance concentrate.
|
| | |
| recommendation for allyl nonanoate usage levels up to : |
| | 10.0000 ppm in the flavor.
|
| | |
| safety links : | |
| (EINECS) number : | 231-334-7 |
| chemidplus : | 007493723 |
| epa-srs : | 7493-72-3 |
| dtp/nci : | 20974 |
| | |
| ifra : | ifra - ( Found under : Allyl esters ) |
| other : | |
| |
|
| references : | |
| pubchem : | 197667 |
| NIST Chemistry WebBook : | 3415491280 |
| | |
| reference : | Mosciano, Gerard P&F 17, No. 1, 41, (1992)³ |