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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | prop-2-enyl (E)-2-methylbut-2-enoate |
| InChI : | InChI=1/C8H12O2/c1-4-6-10-8(9)7(3)5-2/h4-5H,1,6H2,2-3H3/b7-5+ |
| InChIKey : | ODOZNBUSHKFCSH-FNORWQNLBA |
| SMILES : | C\C=C(/C)\C(=O)OCC=C |
| (EINECS) number : | 231-333-1 |
| cas number : | 7493-71-2 |
| fema number : | 2043 |
| coe number : | 2183 |
| jecfa number : | 10 |
| fl. number : | 09.493 |
| molar refractivity : | 40.51 ± 0.3 cm3 |
| parachor : | 347.5 ± 4.0 cm3 |
| index of refraction : | 1.443 ± 0.02 |
| surface tension : | 26.9 ± 3.0 dyne/cm |
| density : | 0.918 ± 0.06 g/cm3 |
| polarizability : | 16.06 ± 0.5 10-24cm3 |
| xlogp : | 1.80 |
| molecular weight : | 140.1796800 |
| formula : | C8 H12 O2 |
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| fda reg : | 172.515 |
h. number : | 2916.19.4000 |
| organoleptics : | |
| odor type : | green |
| odor strength : | medium ,
recommend smelling in a 10.00 % solution or less |
odor description :
at 10.00 % in dipropylene glycol. | green fruity berry |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 97.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.92600 @ 25.00 °C.
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| boiling point : | 172.00 - 173.00 °C. @ 760.00 mm Hg
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| logp : | 2.62 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 140.00 °F. TCC ( 60.00 °C. )
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| IFRA purity specification : | < 0.1% free allyl alcohol |
| recommendation for allyl tiglate usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
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| recommendation for allyl tiglate usage levels up to : |
| | 3.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 231-333-1 |
| chemidplus : | 007493712 |
| epa-srs : | 7493-71-2 |
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| ifra : | ifra - ( Found under : Allyl esters ) |
| other : | |
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| references : | |
| pubchem : | 197666 |
| NIST Chemistry WebBook : | 2820837799 |
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