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| IUPAC name : | ethyl (E)-2-methylpent-2-enoate |
| InChI : | InChI=1/C8H14O2/c1-4-6-7(3)8(9)10-5-2/h6H,4-5H2,1-3H3/b7-6+ |
| InChIKey : | HYQYCHQAUPHFKX-VOTSOKGWBK |
| SMILES : | CC\C=C(/C)\C(=O)OCC |
| (EINECS) number : | 261-367-2 |
| cas number : | 58625-96-0 |
| molar refractivity : | 40.78 ± 0.3 cm3 |
| parachor : | 358.5 ± 4.0 cm3 |
| index of refraction : | 1.431 ± 0.02 |
| surface tension : | 26.8 ± 3.0 dyne/cm |
| density : | 0.902 ± 0.06 g/cm3 |
| polarizability : | 16.16 ± 0.5 10-24cm3 |
| xlogp : | 2.10 |
| molecular weight : | 142.1955600 |
| formula : | C8 H14 O2 |
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| fda reg : | unspecified |
h. number : | 2916.19.4000 |
| organoleptics : | |
| odor type : | jammy |
| odor strength : | medium |
odor description :
at 100.00 %. | sweet berry rum |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 95.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.90000 - 0.92000 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.489 to 7.655
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| refractive index : | 1.42900 - 1.44900 @ 20.00 °C.
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| boiling point : | 171.00 - 172.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 2.93 |
| shelf life : | 48.00 month(s) or longer if stored properly. |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 150.00 °F. TCC ( 65.56 °C. )
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| recommendation for ethyl 2-methyl-2-pentenoate usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 261-367-2 |
| chemidplus : | 058625960 |
| epa-srs : | 58625-96-0 |
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| other : | |
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| references : | |
| pubchem : | 670917 |
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