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| IUPAC name : | butyl undec-10-enoate |
| InChI : | InChI=1/C15H28O2/c1-3-5-7-8-9-10-11-12-13-15(16)17-14-6-4-2/h3H,1,4-14H2,2H3 |
| InChIKey : | GRAORJFMGCQWRN-UHFFFAOYAL |
| SMILES : | CCCCOC(=O)CCCCCCCCC=C |
| (EINECS) number : | 203-670-4 |
| cas number : | 109-42-2 |
| beilstein number : | 1776569 |
| fema number : | 2216 |
| coe number : | 2103 |
| jecfa number : | 344 |
| fl. number : | 09.238 |
| molar refractivity : | 73.04 ± 0.3 cm3 |
| parachor : | 642.6 ± 4.0 cm3 |
| index of refraction : | 1.444 ± 0.02 |
| surface tension : | 29.9 ± 3.0 dyne/cm |
| density : | 0.875 ± 0.06 g/cm3 |
| polarizability : | 28.95 ± 0.5 10-24cm3 |
| xlogp : | 6.00 |
| molecular weight : | 240.3816200 |
| formula : | C15 H28 O2 |
| BioActivity Analysis : | 69066 |
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| fda reg : | 172.515 |
h. number : | unspecified |
| organoleptics : | |
| odor type : | fatty |
| odor strength : | medium |
odor description : at 100.00 %. | fatty butter wine floral fruity |
| substantivity : | 344 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.86800 - 0.87900 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.223 to 7.314
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| refractive index : | 1.43900 - 1.44900 @ 20.00 °C.
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| boiling point : | 249.00 - 254.00 °C. @ 756.00 mm Hg
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| logp : | 6.04 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 5000.00 mg/kg (Moreno, 1977b)
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
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| Maximised Survey-derived Daily Intakes (MSDI) : | 0.037 (μg/capita/day) |
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for butyl undecylenate usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| recommendation for butyl undecylenate usage levels up to : |
| | 60.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 203-670-4 |
| rtecs : | YQ2978000 for 109-42-2 |
| chemidplus : | 000109422 |
| epa-srs : | 109-42-2 |
| dtp/nci : | 2395 |
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| other : | |
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| references : | |
| pubchem : | 197255 |
| NIST Chemistry WebBook : | 4005910990 |
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