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| IUPAC name : | ethyl octanoat |
| InChI : | InChI=1/C10H20O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-9H2,1-2H3 |
| InChIKey : | YYZUSRORWSJGET-UHFFFAOYAU |
| SMILES : | CCCCCCCC(=O)OCC |
| (EINECS) number : | 203-385-5 |
| cas number : | 106-32-1 |
| beilstein number : | 1754470 |
| fema number : | 2449 |
| coe number : | 392 |
| jecfa number : | 33 |
| fl. number : | 09.111 |
| molar refractivity : | 50.15 ± 0.3 cm3 |
| parachor : | 454.7 ± 4.0 cm3 |
| index of refraction : | 1.422 ± 0.02 |
| surface tension : | 28.3 ± 3.0 dyne/cm |
| density : | 0.874 ± 0.06 g/cm3 |
| polarizability : | 19.88 ± 0.5 10-24cm3 |
| xlogp : | 3.80 |
| molecular weight : | 172.2646000 |
| formula : | C10 H20 O2 |
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| fda reg : | 172.515 |
h. number : | 2915.90.0000 |
| organoleptics : | |
| odor type : | waxy |
| odor strength : | medium |
odor description :
at 100.00 %. | fruity wine waxy sweet apricot banana brandy pear |
| taste description³ : | at 7.50 ppm.
Sweet, waxy, fruity and pineapple with creamy, fatty, mushroom and cognac notes |
| substantivity : | 4 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 0.86500 - 0.86800 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.198 to 7.223
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| refractive index : | 1.41700 - 1.41900 @ 20.00 °C.
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| melting point : | -48.00 - -47.00 °C. @ 760.00 mm Hg
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| boiling point : | 206.00 - 208.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 3.81 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Oral-Rat 25960.00 mg/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 167.00 °F. TCC ( 75.00 °C. )
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| recommendation for ethyl octanoate usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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| recommendation for ethyl octanoate usage levels up to : |
| | 60.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 203-385-5 |
| rtecs : | RH0680000 for 106-32-1 |
| chemidplus : | 000106321 |
| epa-srs : | 106-32-1 |
| dtp/nci : | 8898 |
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| other : | |
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| references : | |
| pubchem : | 150893 |
| NIST Chemistry WebBook : | 1140535924 |
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| reference : | Mosciano, Gerard P&F 22, No. 2, 69, (1997)³ |