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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 3-phenylbut-3-enyl acetate |
| InChI : | InChI=1/C12H14O2/c1-10(8-9-14-11(2)13)12-6-4-3-5-7-12/h3-7H,1,8-9H2,2H3 |
| InChIKey : | RIKRCGVPSVKZJW-UHFFFAOYAS |
| SMILES : | CC(=O)OCCC(=C)C1=CC=CC=C1 |
| (EINECS) number : | 230-755-3 |
| cas number : | 7306-12-9 |
| molar refractivity : | 56.12 ± 0.3 cm3 |
| parachor : | 456.4 ± 4.0 cm3 |
| index of refraction : | 1.508 ± 0.02 |
| surface tension : | 34.5 ± 3.0 dyne/cm |
| density : | 1.010 ± 0.06 g/cm3 |
| polarizability : | 22.24 ± 0.5 10-24cm3 |
| xlogp : | 2.80 |
| molecular weight : | 190.2383600 |
| formula : | C12 H14 O2 |
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| fda reg : | unspecified |
h. number : | 2915.39.9050 |
| organoleptics : | |
| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | sweet floral anisyl acetate anisyl alcohol balsam |
| substantivity : | 24 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 90.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.03000 - 1.03800 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.571 to 8.637
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| specific gravity : | 1.03100 - 1.03900 @ 20.00 °C.
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| pounds per gallon - calc. : | 8.589 to 8.656
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| refractive index : | 1.52100 - 1.52600 @ 20.00 °C.
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| boiling point : | 286.00 - 287.00 °C. @ 760.00 mm Hg
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| logp : | 3.01 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for hawthorn acetate usage levels up to : |
| | 20.0000 % in the fragrance concentrate.
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| recommendation for hawthorn acetate usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 230-755-3 |
| chemidplus : | 007306129 |
| epa-srs : | 7306-12-9 |
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| other : | |
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| references : | |
| pubchem : | 658664 |
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