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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (E)-2-(methylsulfanylmethyl)-3-phenylprop-2-enal |
| InChI : | InChI=1/C11H12OS/c1-13-9-11(8-12)7-10-5-3-2-4-6-10/h2-8H,9H2,1H3/b11-7+ |
| InChIKey : | QJDHQEQDIWDMOT-YRNVUSSQBL |
| SMILES : | CSC/C(=C/C1=CC=CC=C1)/C=O |
| cas number : | 65887-08-3 |
| fema number : | 3717 |
| jecfa number : | 505 |
| fl. number : | 12.087 |
| molar refractivity : | 59.43 ± 0.3 cm3 |
| parachor : | 445.5 ± 4.0 cm3 |
| index of refraction : | 1.596 ± 0.02 |
| surface tension : | 32.4 ± 3.0 dyne/cm |
| density : | 1.101 ± 0.06 g/cm3 |
| polarizability : | 23.56 ± 0.5 10-24cm3 |
| xlogp : | 2.60 |
| molecular weight : | 192.2773800 |
| formula : | C11 H12 O S |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | green |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in dipropylene glycol. | green weedy broccoli green bean |
| properties : | |
| appearence : | yellow clear viscous liquid |
| assay : | 96.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.08000 - 1.08500 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.987 to 9.028
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| refractive index : | 1.62200 - 1.63200 @ 20.00 °C.
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| boiling point : | 87.00 °C. @ 13.00 mm Hg
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| boiling point : | 151.00 °C. @ 3.80 mm Hg
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| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | not determined
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| recommendation for alpha-benzylidene methional usage levels up to : |
| | 0.1000 % in the fragrance concentrate.
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| recommendation for alpha-benzylidene methional usage levels up to : |
| | 20.0000 ppm in the flavor.
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| safety links : | |
| chemidplus : | 065887083 |
| epa-srs : | 65887-08-3 |
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| other : | |
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| references : | |
| pubchem : | 198977 |
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