2-acetyl-1-furfuryl pyrrole
1-[1-(furan-2-ylmethyl)-1H-pyrrol-2-yl]ethanone
Identification
| Name | 2-acetyl-1-furfuryl pyrrole |
| IUPAC | 1-[1-(furan-2-ylmethyl)-1H-pyrrol-2-yl]ethanone |
| CAS Number | 13678-73-4 |
| FDA UNII | EJ443MI6K2 |
| Molecular Formula | C11 H11 N O2 |
| Molecular Weight | 189.21407000 |
| CoE Number | 11941 |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Melting Point | 40.00 to 42.00 °C. @ 760.00 mm Hg |
| Boiling Point | 297.00 to 298.00 °C. @ 760.00 mm Hg (est), 100.00 to 102.00 °C. @ 0.03 mm Hg |
| Vapor Pressure | 0.001000 mmHg @ 25.00 °C. (est) |
| Flash Point | 273.00 °F. TCC ( 133.90 °C. ) (est) |
| logP (o/w) | 0.961 (est) |
| Soluble in | alcohol |
Organoleptic Properties
| Taste Description | fruity rose-like |
Safety Information
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavoring agents |
| Recommendation for 2-acetyl-1-furfuryl pyrrole usage levels up to | not for fragrance use. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.091 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | 160 (μg/person/day) |
| Threshold of Concern | 90 (μg/person/day) |
| Structure Class | III |
| Dairy products, excluding products of category 02.0 (01.0) | 0.40000 |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0) | 0.20000 |
| Edible ices, including sherbet and sorbet (03.0) | 0.40000 |
| Processed fruit (04.1) | 0.30000 |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2) | - |
| Confectionery (05.0) | 0.40000 |
| Chewing gum (05.3) | - |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0) | 0.20000 |
| Bakery wares (07.0) | 0.40000 |
| Meat and meat products, including poultry and game (08.0) | 0.10000 |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0) | 0.10000 |
| Eggs and egg products (10.0) | - |
| Sweeteners, including honey (11.0) | - |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0) | 0.20000 |
| Foodstuffs intended for particular nutritional uses (13.0) | 0.40000 |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1) | 0.20000 |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2) | - |
| Ready-to-eat savouries (15.0) | 1.00000 |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0) | 0.20000 |
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Exchange of knowledge
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Potential Uses
Natural Occurrence
Synonyms
2-
acetyl-1-furfurylpyrrole
ethanone, 1-[1-(2-furanylmethyl)-1h-pyrrol-2-yl]-
1-[1-(
furan-2-ylmethyl)-1H-pyrrol-2-yl]ethanone
1-
furfuryl-2-acetyl pyrrole
2--1-
furfuryl-2-acetyl-pyrrole
1-
furfuryl-2-acetylpyrrole
US Patents:
3,952,024 - Furfurylthioacetone
US Patents:
Certain 2,5-dimethyl-3-thiopyrazines