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| IUPAC name : | furan-2-ylmethyl acetate |
| InChI : | InChI=1/C7H8O3/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H3 |
| InChIKey : | CKOYRRWBOKMNRG-UHFFFAOYAE |
| SMILES : | CC(=O)OCC1=CC=CO1 |
| cas number : | 623-17-6 |
| (EINECS) number : | 210-775-9 |
| beilstein number : | 0116128 |
| fema number : | 2490 |
| coe number : | 2065 |
| jecfa number : | 739 |
| fl. number : | 13.128 |
| molar refractivity : | 34.50 ± 0.3 cm3 |
| parachor : | 302.3 ± 4.0 cm3 |
| index of refraction : | 1.464 ± 0.02 |
| surface tension : | 34.1 ± 3.0 dyne/cm |
| density : | 1.120 ± 0.06 g/cm3 |
| polarizability : | 13.68 ± 0.5 10-24cm3 |
| XlogP : | 0.60 |
| molecular weight : | 140.1366200 |
| formula : | C7 H8 O3 |
| BioActivity Analysis : | 17388992 |
| NMR Predictor : | Predict |
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| export tariff code : | 2932.19.0000 |
| fda reg : | unspecified |
Suppliers :
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| Advanced Biotech : | furfuryl acetate
98% min. natural |
| Apple : | Furfuryl acetate
|
| Bedoukian Research : | FURFURYL ACETATE
≥98.0%, Kosher Odor: fruity, banana-like |
| Cargill - Alfrebro : | FURFURYL ACETATE
natural, Kosher |
| Fleurchem : | furfuryl acetate
natural |
| Frutarom : | FURFURYL ACETATE
≥99.00%, NI, Kosher Odor: Fruity, Roast, Sweet |
| Inoue : | FURFURYL ACETATE
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| Penta : | furfuryl acetate
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| Sigma-Aldrich-SAFC : | Furfuryl acetate
≥98%, Kosher, FG |
| Sigma-Aldrich-SAFC : | Furfuryl acetate
≥98%, natural, Kosher |
organoleptics :
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| odor type : | fruity |
| odor strength : | medium |
odor description :¹ at 100.00 %. | sweet fruity banana horseradish |
| odor sample from : | CA Aromatics Company Inc. |
| substantivity : | 12 Hour(s) |
properties :
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| appearence : | yellow clear liquid |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.11000 to 1.11900 @ 25.00 °C.
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| pounds per gallon - calc. : | 9.236 to 9.311
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| refractive index : | 1.45700 to 1.46600 @ 20.00 °C.
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| boiling point : | 175.00 to 177.00 °C. @ 760.00 mm Hg
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| boiling point : | 70.00 °C. @ 4.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| vapor pressure : | 0.90000 mm/Hg @ 20.00 °C. |
| vapor density : | 4.8 ( Air = 1 ) |
| flash point : | 150.00 °F. TCC ( 65.56 °C. )
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| logP (o/w) : | 1.09 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
safety :
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| most important hazard(s) : | Xi - Irritant |
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R 36/37/38 - Irritating to eyes, respiratory system, and skin. 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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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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| Maximised Survey-derived Daily Intakes (MSDI-EU) : | 16.00 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) : | 21.00 (μg/capita/day) |
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| recommendation for furfuryl acetate usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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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 |
| Chemical Carcinogenesis Research Information System : | Search |
| Env. Mutagen Info. Center : | Search |
| National Toxicology Program : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 3 |
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| | furan-2-ylmethyl acetate
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| (EINECS) number : | 210-775-9 |
| RTECS : | LU9120000 for 623-17-6 |
| chemidplus : | 000623176 |
| EPA/NOAA CAMEO : | hazardous materials |
| EPA Substance Registry Services : | 623-17-6 |
references :
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| | furan-2-ylmethyl acetate
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| fl. number : | 13.128 |
| jecfa number : | 739 |
| NIST Chemistry WebBook : | 3542685151 |
| pubchem : | 155490 |
other :
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| reference : | Luebke, William tgsc, (1996)¹ |
| VCF-Online: | VCF Volatile Compounds in Food |