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| IUPAC name : | 2,2-dimethyl-3-(3-methylpenta-2,4-dienyl)oxirane |
| InChI : | InChI=1/C10H16O/c1-5-8(2)6-7-9-10(3,4)11-9/h5-6,9H,1,7H2,2-4H3 |
| InChIKey : | LIMXJCIGROLRED-UHFFFAOYAG |
| SMILES : | CC(=CCC1C(O1)(C)C)C=C |
| cas number : | 69103-20-4 |
| (EINECS) number : | 273-870-4 |
| molar refractivity : | 47.63 ± 0.3 cm3 |
| parachor : | 403.4 ± 4.0 cm3 |
| index of refraction : | 1.457 ± 0.02 |
| surface tension : | 28.3 ± 3.0 dyne/cm |
| density : | 0.870 ± 0.06 g/cm3 |
| polarizability : | 18.88 ± 0.5 10-24cm3 |
| XlogP : | 2.80 |
| molecular weight : | 152.2334400 |
| formula : | C10 H16 O |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Firmenich : | MYROXYDE®
≥90% Odor: Warm complex herbal odour reminiscent of lavender, opoponax, clary sage, absinth and tarragon. |
| Moellhausen : | myroxide
90% min. nature identical kosher Odor: fresh, floral, citrusy, notes of bergamot and muguet |
organoleptics :
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| odor type : | herbal |
| odor strength : | medium |
odor description :¹ at 100.00 %. | sweet metallic fresh herbal lavender opoponax clary pear |
| odor sample from : | Firmenich & Company Inc. |
| substantivity : | 24 Hour(s) |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 98.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.88000 to 0.89000 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.331 to 7.414
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| refractive index : | 1.47200 to 1.47800 @ 20.00 °C.
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| boiling point : | 188.00 to 189.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| flash point : | 158.00 °F. TCC ( 70.00 °C. )
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| logP (o/w) : | 2.59 |
safety :
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| most important hazard(s) : | None - None found. |
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S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes.
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| Oral Toxicity(LD50) : |
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Not determined
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| Dermal Toxicity(LD50) : |
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Not determined
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| Inhalation Toxicity(LC50) : |
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Not determined
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safety in use :
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| recommendation for ocimene oxirane usage levels up to : |
| | 4.0000 % in the fragrance concentrate.
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| recommendation for ocimene oxirane usage levels up to : |
| | not for flavor use.
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safety references :
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| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 2 |
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| | 2,2-dimethyl-3-(3-methylpenta-2,4-dienyl)oxirane
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| (EINECS) number : | 273-870-4 |
| chemidplus : | 069103204 |
| EPA Substance Registry Services : | 69103-20-4 |
references :
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| | 2,2-dimethyl-3-(3-methylpenta-2,4-dienyl)oxirane
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| NIST Chemistry WebBook : | 69103204 |
| pubchem : | 671765 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| reference : | Luebke, William tgsc, (1985)¹ |
| CosIng : | cosmetic data |