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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (4-methoxyphenyl)methyl acetate |
| InChI : | InChI=1/C10H12O3/c1-8(11)13-7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3 |
| InChIKey : | HFNGYHHRRMSKEU-UHFFFAOYAC |
| SMILES : | CC(=O)OCC1=CC=C(C=C1)OC |
| (EINECS) number : | 203-185-8 |
| cas number : | 104-21-2 |
| fema number : | 2098 |
| coe number : | 209 |
| jecfa number : | 873 |
| fl. number : | 09.019 |
| molar refractivity : | 48.88 ± 0.3 cm3 |
| parachor : | 405.0 ± 4.0 cm3 |
| index of refraction : | 1.499 ± 0.02 |
| surface tension : | 35.2 ± 3.0 dyne/cm |
| density : | 1.083 ± 0.06 g/cm3 |
| polarizability : | 19.38 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 180.2004800 |
| formula : | C10 H12 O3 |
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| fda reg : | 172.515 |
h. number : | 2915.39.9050 |
| organoleptics : | |
| odor type : | powdery |
| odor strength : | medium |
odor description :
at 100.00 %. | sweet powdery balsam vanilla fruity plum cherry tonka |
| taste description³ : | at 30.00 ppm.
Sweet, fruity, licorice, cherry, vanilla, coumarin |
| substantivity : | 100 hour(s) at 100.00 % |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 1.10300 - 1.11100 @ 25.00 °C.
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| pounds per gallon - calc. : | 9.178 to 9.245
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| specific gravity : | 1.10400 - 1.11200 @ 20.00 °C.
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| pounds per gallon - calc. : | 9.197 to 9.264
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| refractive index : | 1.55100 - 1.55500 @ 20.00 °C.
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| boiling point : | 137.00 - 139.00 °C. @ 12.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 1.84 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| safety : | |
| most important hazard(s) : |
None - None |
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| Oral Toxicity(LD50) : |
Oral-Rat 2250.00 mg/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit 5000.00 mg/kg
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for para-anisyl acetate usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| recommendation for para-anisyl acetate usage levels up to : |
| | 30.0000 ppm in the flavor.
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| safety links : | |
| msds : | msds |
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| (EINECS) number : | 203-185-8 |
| chemidplus : | 000104212 |
| epa-srs : | 104-21-2 |
| dtp/nci : | 46102 |
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| other : | |
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C of A
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| references : | |
| pubchem : | 150783 |
| NIST Chemistry WebBook : | 930638382 |
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| reference : | Mosciano, Gerard P&F 24, No. 2, 49, (1999)³ |