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| IUPAC name : | ((1-(2-methoxyethoxy)ethoxy)methyl)benzene |
| InChI : | InChI=1/C12H18O3/c1-11(14-9-8-13-2)15-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3 |
| InChIKey : | CNGTXGHYZBQUQS-UHFFFAOYAV |
| SMILES : | CC(OCc1ccccc1)OCCOC |
| cas number : | 7492-39-9 |
| fema number : | 2148 |
| coe number : | 523 |
| jecfa number : | 840 |
| fl. number : | 06.019 |
| molar refractivity : | 59.52 ± 0.3 cm3 |
| parachor : | 499.3 ± 4.0 cm3 |
| index of refraction : | 1.484 ± 0.02 |
| surface tension : | 33.3 ± 3.0 dyne/cm |
| density : | 1.012 ± 0.06 g/cm3 |
| polarizability : | 23.59 ± 0.5 10-24cm3 |
| molecular weight : | 210.2695200 (IUPAC) |
| formula : | C12 H18 O3 |
| NMR Predictor : | Predict |
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| export tariff code : | 2911.00.5000 |
| fda reg : | 172.515 |
Suppliers :
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| Nanjing : | benzyl methoxyethyl acetal
orders in chinese. |
| Penta : | benzyl methoxyethyl acetal
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organoleptics :
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| odor type : | green |
| odor strength : | medium |
odor description:
at 100.00 %. | mild sweet green fruity |
properties :
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| appearence : | colorless clear liquid |
| assay : | 98.00 to 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.01900 to 1.02500 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.479 to 8.529
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| refractive index : | 1.47900 to 1.48900 @ 20.00 °C.
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| boiling point : | 161.00 to 162.00 °C. @ 10.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| flash point : | 210.00 °F. TCC ( 98.89 °C. )
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| logP (o/w) : | 2.39 |
safety :
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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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| Category : | flavor and fragrance agents |
| Maximised Survey-derived Daily Intakes (MSDI-EU) : | ND (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) : | 1.00 (μg/capita/day) |
| Structure Class : | I |
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| recommendation for acetaldehyde benzyl 2-methoxyethyl acetal fragrance usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for acetaldehyde benzyl 2-methoxyethyl acetal flavor usage levels up to : |
| | 1.0000 ppm in the flavor.
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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 |
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((1-(2-methoxyethoxy)ethoxy)methyl)benzene |
| chemidplus : | 007492399 |
| EPA Substance Registry Services : | 7492-39-9 |
references :
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((1-(2-methoxyethoxy)ethoxy)methyl)benzene |
| fl. number : | 06.019 |
| jecfa number : | 840 |
| pubchem : | 204166 |
other :
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| FDA Everything Added to Food in the United States (EAFUS) | View |