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| IUPAC name : | 2-ethoxy-4-methylphenol |
| InChI : | InChI=1/C9H12O2/c1-3-11-9-6-7(2)4-5-8(9)10/h4-6,10H,3H2,1-2H3 |
| InChIKey : | ZWQBCCVEOIYNDL-UHFFFAOYAN |
| SMILES : | CCOC1=C(C=CC(=C1)C)O |
| cas number : | 2563-07-7 |
| molar refractivity : | 44.27 ± 0.3 cm3 |
| parachor : | 356.3 ± 4.0 cm3 |
| index of refraction : | 1.524 ± 0.02 |
| surface tension : | 36.8 ± 3.0 dyne/cm |
| density : | 1.052 ± 0.06 g/cm3 |
| polarizability : | 17.55 ± 0.5 10-24cm3 |
| XlogP : | 2.40 |
| molecular weight : | 152.1903800 |
| formula : | C9 H12 O2 |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Givaudan : | Ultravanil
80%/DPG Odor: Vanilla, Sweet, Phenolic |
organoleptics :
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| odor type : | vanilla |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description :¹ at 10.00 % in dipropylene glycol. | vanilla woody spicy guaiacol |
| odor sample from : | Quest International |
properties :
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| appearence : | pale yellow to yellow clear liquid to solid |
| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.06500 to 1.06700 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.862 to 8.879
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| refractive index : | 1.51000 @ 20.00 °C.
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| boiling point : | 243.00 to 244.00 °C. @ 760.00 mm Hg
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| flash point : | > 200.00 °F. TCC ( > 93.33 °C. )
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| logP (o/w) : | 2.18 |
safety :
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| most important hazard(s) : | Xn - Harmful. |
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R 22 - Harmful if swallowed. R 36/38 - Irritating to skin and eyes. R 43 - May cause sensitisation by skin contact. S 02 - Keep out of the reach of children. S 20/21 - When using do not eat, drink or smoke. 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 37/39 - Wear suitable gloves and eye/face protection.
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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 vanilla cresol usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
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| recommendation for vanilla cresol 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 : | 3 |
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| | 2-ethoxy-4-methylphenol
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| chemidplus : | 002563077 |
| EPA Substance Registry Services : | 2563-07-7 |
references :
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| | 2-ethoxy-4-methylphenol
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| NIST Chemistry WebBook : | 3159180724 |
| pubchem : | 217936 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| reference : | Luebke, William tgsc, (1996)¹ |
| CosIng : | cosmetic data |