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| IUPAC name : | phenylmethyl (E)-2-methylbut-2-enoate |
| InChI : | InChI=1/C12H14O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h3-8H,9H2,1-2H3/b10-3+ |
| InChIKey : | QRGSTISKDZCDHV-XCVCLJGOBP |
| SMILES : | C\C=C(/C)\C(=O)OCC1=CC=CC=C1 |
| (EINECS) number : | 253-544-8 |
| cas number : | 37526-88-8 |
| fema number : | 3330 |
| coe number : | 2184 |
| jecfa number : | 846 |
| fl. number : | 09.494 |
| molar refractivity : | 56.00 ± 0.3 cm3 |
| parachor : | 451.1 ± 4.0 cm3 |
| index of refraction : | 1.516 ± 0.02 |
| surface tension : | 35.2 ± 3.0 dyne/cm |
| density : | 1.027 ± 0.06 g/cm3 |
| polarizability : | 22.20 ± 0.5 10-24cm3 |
| xlogp : | 2.90 |
| molecular weight : | 190.2383600 |
| formula : | C12 H14 O2 |
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| fda reg : | unspecified |
h. number : | 2916.19 |
| organoleptics : | |
| odor type : | balsamic |
| odor strength : | medium |
odor description :
at 100.00 %. | balsamic earthy mushroom rose undertone |
| taste description³ : | at 10.00 ppm.
Balsamic, spice-like with a nutty almond note |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 97.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.02900 - 1.03400 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.562 to 8.604
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| refractive index : | 1.51500 - 1.52100 @ 20.00 °C.
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| boiling point : | 139.00 °C. @ 9.00 mm Hg
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| boiling point : | 250.00 °C. @ 760.00 mm Hg
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| logp : | 3.35 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 230.00 °F. TCC ( > 110.00 °C. )
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| recommendation for (E)-benzyl tiglate usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for (E)-benzyl tiglate usage levels up to : |
| | 10.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 253-544-8 |
| chemidplus : | 037526888 |
| epa-srs : | 37526-88-8 |
| dtp/nci : | 69098 |
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| other : | |
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| references : | |
| pubchem : | 198404 |
| NIST Chemistry WebBook : | 3314233181 |
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| reference : | Mosciano, Gerard P&F 17, No. 3, 57, (1992)³ |