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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate |
| InChI : | InChI=1/C12H20O2/c1-9(2)12(14-11(4)13)7-5-10(3)6-8-12/h5,7,9-10H,6,8H2,1-4H3 |
| InChIKey : | VADBNYMWNNFOSH-UHFFFAOYAP |
| SMILES : | CC1CCC(C=C1)(C(C)C)OC(=O)C |
| cas number : | 8007-35-0 |
| (EINECS) number : | 232-357-5 |
| fema number : | 3047 |
| coe number : | 205 |
| jecfa number : | 368 |
| fl. number : | 09.830 |
| molar refractivity : | 56.58 ± 0.3 cm3 |
| parachor : | 484.7 ± 6.0 cm3 |
| index of refraction : | 1.466 ± 0.02 |
| surface tension : | 31.8 ± 3.0 dyne/cm |
| density : | 0.962 ± 0.06 g/cm3 |
| polarizability : | 22.43 ± 0.5 10-24cm3 |
| XlogP : | 3.10 |
| molecular weight : | 196.2860000 |
| formula : | C12 H20 O2 |
| NMR Predictor : | Predict |
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| export tariff code : | 2915.39.0000 |
| fda reg : | unspecified |
Suppliers :
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| IFF : | Terpinyl Acetate Extra
Odor: Sweet, herbaceous, floral with lavender nuances. |
| IFF : | Terpinyl Acetate JAX
Odor: Sweet, herbaceous, floral with fresh lavender |
| Nippon Terpene : | alpha-Terpinyl acetate
99% |
| Penta : | alpha-terpinyl acetate
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organoleptics :
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| odor type : | herbal |
| odor strength : | medium |
odor description : at 100.00 %. | sweet herbal bergamot pine |
| substantivity : | 24 Hour(s) |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 98.00 to 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| flash point : | 212.00 °F. TCC ( 100.00 °C. )
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| logP (o/w) : | 3.96 |
safety :
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| most important hazard(s) : | Xi - Irritant |
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R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing.
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| Oral Toxicity(LD50) : |
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Gavage-Rat [sex: M,F] 5075.00 mg/kg (Jenner et al., 1964)
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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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| Maximised Survey-derived Daily Intakes (MSDI-EU) : | 220.00 (μg/capita/day) |
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| recommendation for terpineol acetate usage levels up to : |
| | 6.0000 % in the fragrance concentrate.
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| recommendation for terpineol acetate usage levels up to : |
| | not for flavor use.
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safety references :
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| European Food Safety Athority(efsa) : | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| EPI System : | view |
| Toxicology Citations : | Search |
| Env. Mutagen Info. Center : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 2 |
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| | (4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate
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| (EINECS) number : | 232-357-5 |
| chemidplus : | 008007350 |
| EPA Substance Registry Services : | 8007-35-0 |
references :
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| | (4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate
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| fl. number : | 09.830 |
| jecfa number : | 368 |
| pubchem : | 149608 |
Cosmetics :
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| Cosmetic uses : |
masking agents
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other :
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| CosIng : | cosmetic data |