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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 1-methyl-4-propan-2-yl-2-prop-1-enylbenzene |
| InChI : | InChI=1/C13H18/c1-5-6-13-9-12(10(2)3)8-7-11(13)4/h5-10H,1-4H3 |
| InChIKey : | IRICXAFZMINCTB-UHFFFAOYAQ |
| SMILES : | CC=CC1=C(C=CC(=C1)C(C)C)C |
| cas number : | 14374-92-6 |
| (EINECS) number : | 238-347-7 |
| beilstein number : | 2552678 |
| molar refractivity : | 61.15 ± 0.3 cm3 |
| parachor : | 462.9 ± 4.0 cm3 |
| index of refraction : | 1.533 ± 0.02 |
| surface tension : | 30.6 ± 3.0 dyne/cm |
| density : | 0.885 ± 0.06 g/cm3 |
| polarizability : | 24.24 ± 0.5 10-24cm3 |
| XlogP : | 5.30 |
| molecular weight : | 174.2820200 (IUPAC) |
| formula : | C13 H18 |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Givaudan : | Verdoracine
Odor: Green, Carrot, Galbanum |
| John D. Walsh : | Verdoracine
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| Penta : | 4-isopropyl-1-methyl-2-propenylbenzene
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| Vigon : | VERDORACINE
Odor: GREEN, CARROT-LIKE |
organoleptics :
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| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | green sweet carrot dry earthy |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 95.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 245.00 to 246.00 °C. @ 760.00 mm Hg
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| vapor pressure : | 0.04500 mm/Hg @ 25.00 °C. |
| flash point : | 206.00 °F. TCC ( 96.67 °C. )
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| logP (o/w) : | 5.02 |
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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Oral-Rat >5000.00 mg/kg
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| Dermal Toxicity(LD50) : |
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Skin-Rabbit 5000.00 mg/kg
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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 2-propenyl-para-cymene usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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| recommendation for 2-propenyl-para-cymene 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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| | 1-methyl-4-propan-2-yl-2-prop-1-enylbenzene
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| (EINECS) number : | 238-347-7 |
| chemidplus : | 014374926 |
| EPA Substance Registry Services : | 14374-92-6 |
references :
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| | 1-methyl-4-propan-2-yl-2-prop-1-enylbenzene
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| pubchem : | 661296 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |