CAS Number18619-97-1
Synonyms3-Cyan-2-hydroxy-6-methyl-isonicotinsaeure-aethylester; 3-Cyan-2-hydroxy-6-methyl-pyridin-4-carbonsaeure-ethylester; 3-Cyano-6-methyl-2-oxo-1,2-dihydro-pyridine-4-carboxylic acid ethyl ester; 3-cyano-1,2-dihydro-6-methyl-2-oxo-4-pyridinecarboxylic acid,ethyl ester; ethyl 3-cyano-2-hydroxy-6-methylisonicotinate; 3-cyano-2-hydroxy-6-methyl-isonicotinic acid ethyl ester; ethyl 3-cyano-2-hydroxy-6-methylpyridine-4-carboxylate; ethyl3-cyano-6-methyl-2-oxo-1,2-dihydropyridine-4-carboxylate; 4-Ethoxycarbonyl-3-cyan-2-hydroxy-6-methyl-pyridin
Molecular FormulaC10H10O3N2
Molecular Weight206.2
Purity96+%
Density1.26g/cm3
Boiling Point371.6ºC at 760mmHg
Melting Point219℃
EINECS0
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 18619-97-1 |
| Catalog No. | 2A-0154208 |
| Chinese Name | 3-氰基-2-羟基-6-甲基异烟酸乙酯 |
| Synonyms | 3-Cyan-2-hydroxy-6-methyl-isonicotinsaeure-aethylester; 3-Cyan-2-hydroxy-6-methyl-pyridin-4-carbonsaeure-ethylester; 3-Cyano-6-methyl-2-oxo-1,2-dihydro-pyridine-4-carboxylic acid ethyl ester; 3-cyano-1,2-dihydro-6-methyl-2-oxo-4-pyridinecarboxylic acid,ethyl ester; ethyl 3-cyano-2-hydroxy-6-methylisonicotinate; 3-cyano-2-hydroxy-6-methyl-isonicotinic acid ethyl ester; ethyl 3-cyano-2-hydroxy-6-methylpyridine-4-carboxylate; ethyl3-cyano-6-methyl-2-oxo-1,2-dihydropyridine-4-carboxylate; 4-Ethoxycarbonyl-3-cyan-2-hydroxy-6-methyl-pyridin |
| Molecular Formula | C10H10O3N2 |
| Molecular Weight | 206.2 |
| Purity | 96+ |
| Density | 1.26g/cm3 |
| Boiling Point | 371.6ºC at 760mmHg |
| Melting Point | 219℃ |
| Storage Condition | room temperature, dry |
| EINECS | 0 |
| HTC | 2933399090 |
| UN(IATA) | 0 |
| PubChem ID | 80800 |
| MDL Number | MFCD08446474 |
| SMILES | CCOC(=O)c1cc(C)[nH]c(=O)c1C#N |
| InChI | InChI=1S/C10H10N2O3/c1-3-15-10(14)7-4-6(2)12-9(13)8(7)5-11/h4H,3H2,1-2H3,(H,12,13) |
| InChI Key | RJJRKBMJIICKDK-UHFFFAOYSA-N |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point: Flash point:No data Molecular formula:C10H10N2O3 Molecular weight:206.2 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Safety Information Hazard Codes Xi: Irritant; HS Code 2933399090 Synthetic Route Ethyl acetopyruvate CAS#:615-79-2 2-Cyanoacetamide CAS#:107-91-5 4-Pyridinecarbo... CAS#:18619-97-1 Literature: Schmidt, Gunther; Reber, Stefan; Bolli, Martin H.; Abele, Stefan Organic Process Research and Development, 2012 , vol. 16, # 4 p. 595 - 604 Ethyl acetoacetate CAS#:141-97-9 2-Cyanoacetamide CAS#:107-91-5 4-Pyridinecarbo... CAS#:18619-97-1 Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 24, # 1 p. 156 - 160 2-Cyanoacetamide CAS#:107-91-5 4-Pyridinecarbo... CAS#:18619-97-1 Literature: Journal of the Chemical Society, , p. 2229 Precursor & DownStream Precursor 3 CAS#:615-79-2 Ethyl acetopyruvate CAS#:107-91-5 2-Cyanoacetamide CAS#:141-97-9 Ethyl acetoacetate DownStream 10 CAS#:3222-48-8 6-Methylnicotin... CAS#:40108-12-1 ethyl 2-chloro-... CAS#:3998-90-1 Methyl 2-chloro... CAS#:98491-78-2 Methyl 2-hydrox... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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