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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | [(E)-2-phenylprop-1-enyl] acetate |
| InChI : | InChI=1/C11H12O2/c1-9(8-13-10(2)12)11-6-4-3-5-7-11/h3-8H,1-2H3/b9-8+ |
| InChIKey : | CLCGEEANBAUENX-CMDGGOBGBD |
| SMILES : | C/C(=C\OC(=O)C)/C1=CC=CC=C1 |
| (EINECS) number : | 253-735-6 |
| cas number : | 37973-51-6 |
| molar refractivity : | 51.82 ± 0.3 cm3 |
| parachor : | 414.8 ± 4.0 cm3 |
| index of refraction : | 1.520 ± 0.02 |
| surface tension : | 35.2 ± 3.0 dyne/cm |
| density : | 1.034 ± 0.06 g/cm3 |
| polarizability : | 20.54 ± 0.5 10-24cm3 |
| xlogp : | 2.50 |
| molecular weight : | 176.2117800 |
| formula : | C11 H12 O2 |
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| export tariff code : | 2915.39.9050 |
| fda reg : | unspecified |
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organoleptics :
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| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | sweet honey neroli hyacinth |
properties :
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| appearence : | pale yellow clear liquid |
| assay : | 95.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.04700 @ 25.00 °C.
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| refractive index : | 1.53200 - 1.53500 @ 20.00 °C.
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| boiling point : | 95.00 °C. @ 2.00 mm Hg
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| boiling point : | 249.00 - 250.00 °C. @ 760.00 mm Hg
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| logp : | 3.42 |
safety :
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| Oral Toxicity(LD50) : |
Oral-Mouse 1.70 gm/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 200.00 °F. TCC ( > 93.33 °C. )
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| recommendation for (E)-2-phenyl-1(2)-propene-1-yl acetate usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for (E)-2-phenyl-1(2)-propene-1-yl acetate usage levels up to : |
| | not for flavor use.
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safety links :
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| (EINECS) number : | 253-735-6 |
| chemidplus : | 037973516 |
| epa-srs : | 37973-51-6 |
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other :
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references :
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| pubchem : | 739811 |
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