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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | prop-2-enyl 4-cyclohexylbutanoate |
| InChI : | InChI=1/C13H22O2/c1-2-11-15-13(14)10-6-9-12-7-4-3-5-8-12/h2,12H,1,3-11H2 |
| InChIKey : | SIIAEMSHVLJRHI-UHFFFAOYAX |
| SMILES : | C=CCOC(=O)CCCC1CCCCC1 |
| cas number : | 7493-65-4 |
| fema number : | 2024 |
| coe number : | 283 |
| jecfa number : | 14 |
| fl. number : | 09.411 |
| molar refractivity : | 61.66 ± 0.3 cm3 |
| parachor : | 537.0 ± 4.0 cm3 |
| index of refraction : | 1.459 ± 0.02 |
| surface tension : | 32.3 ± 3.0 dyne/cm |
| density : | 0.934 ± 0.06 g/cm3 |
| polarizability : | 24.44 ± 0.5 10-24cm3 |
| xlogp : | 4.70 |
| molecular weight : | 210.3125800 |
| formula : | C13 H22 O2 |
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| fda reg : | 172.515 |
h. number : | 2915.60.0000 |
| organoleptics : | |
| odor type : | fruity |
| odor strength : | medium |
odor description :
at 100.00 %. | pineapple |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| refractive index : | 1.46080 @ 20.50 °C.
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| boiling point : | 104.00 °C. @ 1.00 mm Hg
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| logp : | 4.65 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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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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| IFRA purity specification : | < 0.1% free allyl alcohol |
| recommendation for allyl cyclohexyl butyrate usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| recommendation for allyl cyclohexyl butyrate usage levels up to : |
| | 20.0000 ppm in the flavor.
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| safety links : | |
| chemidplus : | 007493654 |
| epa-srs : | 7493-65-4 |
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| other : | |
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| references : | |
| pubchem : | 197662 |
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