| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 104-90-5 |
| ECHA EC Number: | 203-250-0 |
| FDA UNII: | WG205CGK3Y |
| CoE Number: | 11385 |
| Category: | flavoring agents |
| IUPAC Name: | 5-ethyl-2-methyl pyridine |
| InChI : | InChI=1/C8H11N/c1-3-8-5-4-7(2)9-6-8/h4-6H,3H2,1-2H3 |
| Std.InChI: | InChI=1S/C8H11N/c1-3-8-5-4-7(2)9-6-8/h4-6H,3H2,1-2H3 |
| InChIKey : | NTSLROIKFLNUIJ-UHFFFAOYAH |
| Std.InChIKey: | NTSLROIKFLNUIJ-UHFFFAOYSA-N |
| SMILES : | CCC1=CN=C(C=C1)C |
| MDL: | MFCD00006344 |
| Molar Refractivity : | 38.71 ± 0.3 cm3 (est) |
| Parachor : | 315.6 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.499 ± 0.02 (est) |
| Surface Tension : | 32.9 ± 3.0 dyne/cm (est) |
| Density : | 0.919 ± 0.06 g/cm3 (est) |
| Polarizability : | 15.34 ± 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: | 1318 5-ethyl-2-methylpyridine |
| DG SANTE Food Flavourings: | 14.066 5-ethyl-2-methylpyridine |
| FEMA Number: | 3546 5-ethyl-2-methylpyridine |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 104-90-5 ; 5-ETHYL-2-METHYLPYRIDINE |
| Appearance: | yellow clear liquid (est) |
| Assay: | 97.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.91700 to 0.92300 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.630 to 7.680 |
| Refractive Index: | 1.49500 to 1.50200 @ 20.00 °C. |
| Boiling Point: | 172.00 to 175.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 1.430000 mmHg @ 25.00 °C. |
| Vapor Density: | 4.2 ( Air = 1 ) |
| Flash Point: | 151.00 °F. TCC ( 66.11 °C. ) |
| logP (o/w): | 2.178 (est) |
| Soluble in: | |
| alcohol | |
| water, 12000 mg/L @ 20 °C (exp) | |
| Insoluble in: | |
| water | |
| None found |
| Beijing Lys Chemicals |
| 5-Ethyl-2-methylpyridine |
| EMD Millipore |
| For experimental / research use only. |
| 5-Ethyl-2-methylpyridine |
| Parchem |
| 5-ethyl-2-methyl pyridine |
| Penta International |
| 5-ETHYL-2-METHYL PYRIDINE |
| R C Treatt & Co Ltd |
| 5-Ethyl-2-methylpyridine |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 5-Ethyl-2-methylpyridine |
| Sigma-Aldrich |
| 5-Ethyl-2-methylpyridine, ≥96% |
| Certified Food Grade Products |
| Synerzine |
| 5-Ethyl-2-Methylpyridine |
| TCI AMERICA |
| For experimental / research use only. |
| 5-Ethyl-2-methylpyridine >95.0%(GC) |
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xn - Harmful. | |
| R 20/22 - Harmful by inhalation and if swallowed. R 52/53 - Harmful to qauatic organisms, may cause long-term adverse effects in the aquatic environment. S 02 - Keep out of the reach of children. S 20/21 - When using do not eat, drink or smoke. S 23 - Do not breath vapour. 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 36/37/39 - Wear suitable clothing, gloves and eye/face protection. S 45 - In case of accident or if you feel unwell seek medical advice immediately. 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. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 1540 mg/kg (Smyth et al., 1951a) oral-rat LD50 368 mg/kg (Izmerov et al., 1982) oral-mouse LD50 282 mg/kg (Izmerov et al., 1982) oral-mouse LD50 282 mg/kg "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 83, 1982. oral-rat LD50 1300 uL/kg LUNGS, THORAX, OR RESPIRATION: DYSPNEABEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) National Technical Information Service. Vol. OTS0571695 | |
| Dermal Toxicity: | |
| skin-rabbit LD50 566 ul/kg LIVER: OTHER CHANGESLUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA National Technical Information Service. Vol. OTS0571695 subcutaneous-rat LD50 826 mg/kg "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 83, 1982. subcutaneous-mouse LD50 294 mg/kg "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 83, 1982. skin-guinea pig LD50 2500 mg/kg "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 846, 1986. | |
| Inhalation Toxicity: | |
| inhalation-rat LC50 540 ppm/4H BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)BEHAVIORAL: ATAXIA National Technical Information Service. Vol. OTS0571695 | |
| Category: | |||
| flavoring agents | |||
| Recommendation for 5-ethyl-2-methyl pyridine usage levels up to: | |||
| not for fragrance use. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.12 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 0.04 (μg/capita/day) | ||
| Structure Class: | II | ||
| 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: 11 | |||
| Click here to view publication 11 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 1.50000 | |
| beverages(nonalcoholic): | - | - | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | 1.00000 | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | 0.50000 | |
| hard candy: | - | - | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | 0.05000 | |
| jams / jellies: | - | - | |
| meat products: | - | 1.00000 | |
| milk products: | - | - | |
| nut products: | - | 1.00000 | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | - | - | |
| soft candy: | - | - | |
| soups: | - | 0.50000 | |
| 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): |
| Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 24 (FGE.24): Pyridine, pyrrole, indole and quinoline derivatives from chemical group 28 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf |
| Pyridine, pyrrole, indole and quinoline derivatives from chemical group 28 Flavouring Group Evaluation 24, Revision 1 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf |
| Flavouring Group Evaluation 77 (FGE77) [1] - Consideration of Pyridine, Pyrrole and Quinoline Derivatives evaluated by JECFA (63rd meeting) structurally related to Pyridine, Pyrrole, Indole and Quinoline Derivatives evaluated by EFSA in FGE.24Rev1 (2008) View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 77, Revision 2 (FGE.77Rev2): Consideration of Pyridine, Pyrrole and Quinoline Derivatives evaluated by JECFA (63rd meeting) structurally related to Pyridine, Pyrrole, Indole and Quinoline Derivatives evaluated by EFSA in FGE.24Rev2 (2013) View page or View pdf |
| Scientific opinion on flavouring group evaluation 77, revision 3 (FGE.77Rev3): consideration of pyridine, pyrrole and quinoline derivatives evaluated by JECFA (63rd meeting) structurally related to pyridine, pyrrole, indole and quinoline derivatives evaluated by EFSA in FGE.24Rev2 View page or View pdf |
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA GENetic TOXicology:Search |
| EPA Substance Registry Services (TSCA):104-90-5 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :7728 |
| National Institute of Allergy and Infectious Diseases:Data |
| WISER:UN 2300 |
| WGK Germany:1 |
| 5-ethyl-2-methylpyridine |
| Chemidplus:0000104905 |
| EPA/NOAA CAMEO:hazardous materials |
| RTECS:TJ6825000 for cas# 104-90-5 |
| 5-ethyl-2-methylpyridine | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 104-90-5 |
| Pubchem (cid): | 7728 |
| Pubchem (sid): | 134970832 |
| (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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB29729 |
| FooDB: | FDB000925 |
| Export Tariff Code: | 2933.39.9100 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Formulations/Preparations: •grade: technical•grades or purity: 99.9% | |
| 2,5- | aldehydine |
| 5- | ethyl-2-methyl-pyridin |
| 5- | ethyl-2-methylpyridine |
| 5- | ethyl-2-picoline |
| 3- | ethyl-6-methyl pyridine |
| 3- | ethyl-6-methylpyridine |
| 5- | ethyl-alpha-picoline |
| 6- | methyl-3-ethyl pyridine |
| 6- | methyl-3-ethylpyridine |
| 2- | methyl-5-ethyl pyridine |
| 2- | methyl-5-ethylpyridine |
| 2- | picoline, 5-ethyl- |
| pyridine, 5-ethyl-2-methyl- |
| US Patents:3,931,166 - Certain 2,5-dimethyl-3-thiopyrazines |
| US Patents:Flavoring agent |
