| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 1309389-73-8 |
| FDA UNII: | 0TA0227SQW |
| Category: | flavoring agents |
| IUPAC Name: | (E)-3-benzo[1,3]dioxol-5-yl-N,N-diphenyl-2-propenamide |
| InChI : | InChI=1/C21H25NO5/c1-24-17-8-5-15(13-19(17)26-3)7-10-21(23)22-12-11-16-6-9-18(25-2)20(14-16)27-4/h5-10,13-14H,11-12H2,1-4H3,(H,22,23)/b10-7+ |
| Std.InChI: | InChI=1S/C21H25NO5/c1-24-17-8-5-15(13-19(17)26-3)7-10-21(23)22-12-11-16-6-9-18(25-2)20(14-16)27-4/h5-10,13-14H,11-12H2,1-4H3,(H,22,23)/b10-7+ |
| InChIKey : | OZNUPWACHHUIKC-JXMROGBWBB |
| Std.InChIKey: | OZNUPWACHHUIKC-JXMROGBWSA-N |
| SMILES : | COC1=C(C=C(C=C1)CCNC(=O)/C=C/C2=CC(=C(C=C2)OC)OC)OC |
| Molar Refractivity : | 102.95 ± 0.5 cm3 (est) |
| Parachor : | 827.6 ± 8.0 cm3 (est) |
| Index of Refraction : | 1.521 ± 0.05 (est) |
| Surface Tension : | 35.9 ± 7.0 dyne/cm (est) |
| Density : | 1.09 ± 0.1 g/cm3 (est) |
| Polarizability : | 40.81 ± 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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 2228 (E)-3-benzo[1,3]dioxol-5-yl-N,N-diphenyl-2-propenamide |
| FEMA Number: | 4788 (E)-3-benzo[1,3]dioxol-5-yl-N,N-diphenyl-2-propenamide |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| Appearance: | white powder (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Melting Point: | 144.00 to 145.00 °C. @ 760.00 mm Hg |
| Soluble in: | |
| water, 19.53 mg/L @ 25 °C (est) | |
| None found |
| Chemical Sources Association |
| Need This Item for Flavor/Food?: You can contact the Chemical Sources Association |
| 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. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| flavoring agents | |||
| Recommendation for (E)-3-benzo[1,3]dioxol-5-yl-N,N-diphenyl-2-propenamide usage levels up to: | |||
| not for fragrance use. | |||
| 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: 27. Update in publication number(s): 29 | |||
| Click here to view publication 27 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | - | |
| beverages(nonalcoholic): | 0.02000 | 0.20000 | |
| beverages(alcoholic): | 0.04000 | 2.00000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | 150.00000 | 500.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | 10.00000 | 150.00000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | 40.00000 | 400.00000 | |
| 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: | 20.00000 | 200.00000 | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :1042026 |
| National Institute of Allergy and Infectious Diseases:Data |
| (2E)-3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]prop-2-enamide |
| Chemidplus:0121817650 |
| (2E)-3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]prop-2-enamide | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 1042026 |
| Pubchem (cas): | 1309389-73-8 |
| (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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB32226 |
| ChemSpider: | View |
| None Found |
| not found in nature |
| (2E)-3-(1,3- | benzodioxol-5-yl)-N,N-diphenylprop-2-enamide |
| (2E)-3-(3,4- | dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acrylamide |
| (2E)-3-(3,4- | dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]prop-2-enamide |
| 2- | propenamide, 3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-, (2E)- |
| rubemamine |
| None found yet. Try the PubMed Search. |
