| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 103-50-4 |
| ECHA EC Number: | 203-118-2 |
| FDA UNII: | 2O6CNO27RJ |
| CoE Number: | 11856 |
| Category: | flavor and fragrance agents |
| IUPAC Name: | dibenzyl ether |
| InChI : | InChI=1/C14H14O/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| Std.InChI: | InChI=1S/C14H14O/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey : | MHDVGSVTJDSBDK-UHFFFAOYAM |
| Std.InChIKey: | MHDVGSVTJDSBDK-UHFFFAOYSA-N |
| SMILES : | C1=CC=C(C=C1)COCC2=CC=CC=C2 |
| MDL: | MFCD00004780 |
| Molar Refractivity : | 62.03 ± 0.3 cm3 (est) |
| Parachor : | 475.6 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.569 ± 0.02 (est) |
| Surface Tension : | 39.8 ± 3.0 dyne/cm (est) |
| Density : | 1.047 ± 0.06 g/cm3 (est) |
| Polarizability : | 24.59 ± 0.5 10-24cm3 (est) |
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 1256 dibenzyl ether |
| DG SANTE Food Flavourings: | 03.004 dibenzyl ether |
| FEMA Number: | 2371 dibenzyl ether |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 103-50-4 ; DIBENZYL ETHER |
| FDA Regulation: | |
| FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION Subpart F--Flavoring Agents and Related Substances Sec. 172.515 Synthetic flavoring substances and adjuvants. | |
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 99.00 to 100.00 |
| Food Chemicals Codex Listed: | Yes |
| Specific Gravity: | 1.03900 to 1.04400 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 8.646 to 8.687 |
| Refractive Index: | 1.56100 to 1.56200 @ 20.00 °C. |
| Melting Point: | 1.50 to 3.50 °C. @ 760.00 mm Hg |
| Boiling Point: | 295.00 to 298.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 170.00 °C. @ 16.00 mm Hg |
| Vapor Pressure: | 0.001030 mmHg @ 25.00 °C. |
| Vapor Density: | 6.8 ( Air = 1 ) |
| Flash Point: | 275.00 °F. TCC ( 135.00 °C. ) |
| logP (o/w): | 3.310 |
| Soluble in: | |
| alcohol | |
| water, 40 mg/L @ 35 °C (exp) | |
| Insoluble in: | |
| water | |
| Stability: | |
| cream | |
| lipstick | |
| non-discoloring in most media | |
| shampoo | |
| soap | |
| CosIng: | cosmetic data |
| Cosmetic Uses: | perfuming agents |
| Augustus Oils |
| Dibenzyl Ether |
| Services |
| Berjé |
| Dibenzyl Ether |
| Media |
| BOC Sciences |
| For experimental / research use only. |
| Dibenzyl Ether |
| EMD Millipore |
| For experimental / research use only. |
| Dibenzyl Ether |
| Lluch Essence |
| DIBENZYL ETHER 98% Odor: FRUITY, FLORAL |
| Moellhausen |
| DIBENZYL OXIDE Odor: aromatic, floral, somewhat fruity; rose-like connotations Flavor: fruity, spicy, nut-like |
| OQEMA |
| Dibenzyl Ether |
| Penta International |
| DIBENZYL ETHER FCC |
| Penta International |
| DIBENZYL ETHER |
| R C Treatt & Co Ltd |
| Dibenzyl Oxide |
| Reincke & Fichtner |
| Dibenzyl Ether |
| Sigma-Aldrich |
| Benzyl ether, ≥98%, FCC, FG Odor: almond; chocolate; spicy; fruity; sweet. |
| Certified Food Grade Products |
| TCI AMERICA |
| For experimental / research use only. |
| Dibenzyl Ether >95.0%(GC) |
| The John D. Walsh Company |
| Dibenzyl Ether |
| Vigon International |
| Dibenzyl Ether |
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xi N - Irritant, Dangerous for the environment. | |
| R 36/37/38 - Irritating to eyes, respiratory system, and skin. R 51/53 - Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. 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 - Wear suitable protective clothing. S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet. | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Human Experience: | |
| 4 % solution: no irritation or sensitization. | |
| Oral/Parenteral Toxicity: | |
| oral-mouse LD50 4300 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)LUNGS, THORAX, OR RESPIRATION: DYSPNEABEHAVIORAL: FOOD INTAKE (ANIMAL) Toksikologicheskii Vestnik. Vol. (1), Pg. 34, 1997. oral-rat LD50 2500 mg/kg Food and Cosmetics Toxicology. Vol. 16, Pg. 703, 1978. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| flavor and fragrance agents | |||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| IFRA Critical Effect: | |||
| Dermal sensitization and systemic toxicity | |||
| View the IFRA Standard | |||
| View IFRA Standards Library for complete information. | |||
| Please review Amendment 49 IFRA documentation for complete information. | |||
| IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%): | |||
| Category 1: Products applied to the lips | |||
| 0.000040 % | |||
| Category 2: Products applied to the axillae | |||
| 0.0028 % | |||
| Category 3: Products applied to the face/body using fingertips | |||
| 0.00020 % | |||
| Category 4: Products related to fine fragrance | |||
| 0.012 % | |||
| Category 5: Products applied to the face and body using the hands (palms), primarily leave-on | |||
| Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on | |||
| 0.0023 % | |||
| Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on | |||
| 0.00024 % | |||
| Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on | |||
| 0.00032 % | |||
| Category 5D: Baby Creams, baby Oils and baby talc | |||
| 0.000081 % | |||
| Category 6: Products with oral and lip exposure | |||
| 0.0023 % | |||
| Category 7: Products applied to the hair with some hand contact | |||
| Category 7A: Rinse-off products applied to the hair with some hand contact | |||
| 0.00093 % | |||
| Category 7B: Leave-on products applied to the hair with some hand contact | |||
| 0.00093 % | |||
| Category 8: Products with significant anogenital exposure | |||
| 0.000081 % | |||
| Category 9: Products with body and hand exposure, primarily rinse off | |||
| 0.0037 % | |||
| Category 10: Household care products with mostly hand contact | |||
| Category 10A: Household care excluding aerosol products (excluding aerosol/spray products) | |||
| 0.0037 % | |||
| Category 10B: Household aerosol/spray products | |||
| 0.0037 % | |||
| Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate | |||
| Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure | |||
| 0.000081 % | |||
| Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure | |||
| 0.000081 % | |||
| Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin | |||
| 0.24 % | |||
| Notes: | |||
| IFRA FLAVOR REQUIREMENTS: | |||
Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.49 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 241.00 (μg/capita/day) | ||
| Structure Class: | III | ||
| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). | |||
| The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library | |||
| publication number: 3 | |||
| Click here to view publication 3 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 25.00000 | |
| beverages(nonalcoholic): | - | 8.30000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | 85.00000 | 160.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 5.60000 | |
| fruit ices: | - | 5.60000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 23.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | - | - | |
| meat products: | - | - | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | - | - | |
| soft candy: | - | - | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
| European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): |
| Flavouring Group Evaluation 59 (FGE.59): Consideration of aliphatic and aromatic ethers evaluated by JECFA (61st meeting) structurally related to aliphatic, alicyclic and aromatic ethers including anisole derivatives evaluated by EFSA in FGE.23 (2006) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 59, Revision 1 (FGE.59Rev1): Consideration of aliphatic and aromatic ethers evaluated by JECFA (61st meeting and 63rd meeting) structurally related to aliphatic, alicyclic and aromatic ethers including anisole derivatives evaluated by EFSA in FGE.23 Rev2 (2010) View page or View pdf |
| EPI System: View |
| Chemical Carcinogenesis Research Information System:Search |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):103-50-4 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :7657 |
| National Institute of Allergy and Infectious Diseases:Data |
| WISER:UN 3082 |
| WGK Germany:2 |
| phenylmethoxymethylbenzene |
| Chemidplus:0000103504 |
| EPA/NOAA CAMEO:hazardous materials |
| RTECS:DQ6125000 for cas# 103-50-4 |
| phenylmethoxymethylbenzene | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 103-50-4 |
| Pubchem (cid): | 7657 |
| Pubchem (sid): | 134972229 |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Substances Added to Food (formerly EAFUS): | View |
| CHEBI: | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB32078 |
| FooDB: | FDB008793 |
| Export Tariff Code: | 2909.30.6000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| Formulations/Preparations: grade: technical | |
| benzene, 1,1'-(oxybis(methylene))bis- | |
| benzene, 1,1'-[oxybis(methylene)]bis- | |
| benzene, 1,1'-oxybis(methylene- | |
| benzene,1'-[oxybis(methylene)]bis- | |
| benzyl ether | |
| benzyl oxide | |
| di benzyl ether | |
| dibenzyl ether FCC | |
| dibenzyl oxide | |
| dibenzylether | |
| ether, dibenzyl | |
| 1,1-oxybis | methylene, bis benzene |
| 1,1'-oxybis( | methylene) benzene |
| 1,1'-(oxybis( | methylene)) bisbenzene |
| 1,1-(oxybis( | methylene))bisbenzene |
| 1,1'-(oxybis( | methylene))bisbenzene |
| 1,1'-[oxybis( | methylene)]dibenzene |
| phenylmethoxymethylbenzene | |
| plasticator BA | |
| plastikator BA |
