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| IUPAC name : | 2-methoxy-3-methylpyrazine |
| InChI : | InChI=1/C6H8N2O/c1-5-6(9-2)8-4-3-7-5/h3-4H,1-2H3 |
| InChIKey : | VKJIAEQRKBQLLA-UHFFFAOYAT |
| SMILES : | CC1=NC=CN=C1OC |
| cas number : | 2847-30-5 |
| (EINECS) number : | 220-651-6 |
| fema number : | 3183 |
| coe number : | 2266 |
| jecfa number : | 788 |
| fl. number : | 14.126 |
| molar refractivity : | 33.93 ± 0.3 cm3 |
| parachor : | 289.8 ± 4.0 cm3 |
| index of refraction : | 1.496 ± 0.02 |
| surface tension : | 38.7 ± 3.0 dyne/cm |
| density : | 1.068 ± 0.06 g/cm3 |
| polarizability : | 13.45 ± 0.5 10-24cm3 |
| XlogP : | 1.00 |
| molecular weight : | 124.1405200 |
| formula : | C6 H8 N2 O |
| NMR Predictor : | Predict |
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| IUPAC name : | 2-methoxy-6-methylpyrazine |
| InChI : | InChI=1/C6H8N2O/c1-5-3-7-4-6(8-5)9-2/h3-4H,1-2H3 |
| InChIKey : | MYDVJLOKNIAHPH-UHFFFAOYAN |
| SMILES : | CC1=CN=CC(=N1)OC |
| cas number : | 2882-21-5 |
| (EINECS) number : | 220-737-3 |
| fema number : | 3183 |
| coe number : | 2266 |
| fl. number : | 14.025 |
| molar refractivity : | 33.93 ± 0.3 cm3 |
| parachor : | 289.8 ± 4.0 cm3 |
| index of refraction : | 1.496 ± 0.02 |
| surface tension : | 38.7 ± 3.0 dyne/cm |
| density : | 1.068 ± 0.06 g/cm3 |
| polarizability : | 13.45 ± 0.5 10-24cm3 |
| XlogP : | 1.00 |
| molecular weight : | 124.1405200 |
| formula : | C6 H8 N2 O |
| NMR Predictor : | Predict |
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| export tariff code : | 2933.90 |
| fda reg : | unspecified |
organoleptics :
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| odor type : | chocolate |
properties :
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| appearence : | colorless clear liquid |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| vapor pressure : | 0.58400 mm/Hg @ 25.00 °C. |
| vapor density : | 4.2 ( Air = 1 ) |
| flash point : | 130.00 °F. TCC ( 54.44 °C. )
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| logP (o/w) : | 1.24 |
safety :
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| most important hazard(s) : | Xn - Harmful. |
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R 10 - Flammable. R 22 - Harmful if swallowed. R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, 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 chocolate pyrazine B usage levels up to : |
| | not for fragrance use.
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| recommendation for chocolate pyrazine B usage levels up to : |
| | 5.0000 ppm in the flavor.
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safety references :
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| EPI System : | view |
| Env. Mutagen Info. Center : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
| WISER : | UN 1993 |
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| WGK Germany : | 3 |
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| | 2-methoxy-3-methylpyrazine
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| (EINECS) number : | 220-651-6 |
| chemidplus : | 002847305 |
| EPA Substance Registry Services : | 2847-30-5 |
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| | 2-methoxy-6-methylpyrazine
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| (EINECS) number : | 220-737-3 |
| chemidplus : | 002882215 |
| EPA Substance Registry Services : | 2882-21-5 |
references :
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| | 2-methoxy-3-methylpyrazine
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| fl. number : | 14.126 |
| jecfa number : | 788 |
| NIST Chemistry WebBook : | 1605373978 |
| pubchem : | 161011 |
| | 2-methoxy-6-methylpyrazine
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| fl. number : | 14.025 |
| NIST Chemistry WebBook : | 178627740 |
| pubchem : | 10517161 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |
| VCF-Online: | VCF Volatile Compounds in Food |