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6-氯吡啶-3-羧酸乙酯
Ethyl 6-chloropyridine-3-carboxylate
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| 半岛bd体育手机客户端 编号 | 包装单位 | 单价(元) | 国内现货 | 国外库存 | 询价单 |
| 3085190 | 25 G | 438 |
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别名
49608-01-7
6-氯吡啶-3-羧酸乙酯
Ethyl 6-chloropyridine-3-carboxylate
Ethyl 6-Chloronicotinate
6-氯烟酸乙酯
结构式
基本信息
| Empirical Formula【经验(实验)分子式】 | C8H8ClNO2 |
| Molecular weight | 185.61 |
| MDL number | MFCD00082739 |
| PubChem Substance ID【PubChem化学物质编号】 | 24877807 |
| NACRES | NA.22 |
| General description【一般描述】 | Ethyl 6-chloropyridine-3-carboxylate (Ethyl-6-chloronicotinate, E-6-ClN) undergoes direct amidation on reacting with benzylamine in the presence lanthanum trifluoromethanesulfonate La(OTf)3. The structural and physicochemical properties of E-6-ClN have been investigated based on its spectroscopic data, time-dependent density functional theory and density of state diagrams. |
| Application【应用】 | Ethyl 6-chloropyridine-3-carboxylate (Ethyl 6-chloronicotinate) may be used in the preparation of ethyl 5-{[5-(1H-benzimidazol-2-yl)pyridin-2-yl]ethynyl}pyridine-2-carboxylate by reacting with 2-[6-(ethynyl)pyridin-3-yl]-1H-benzimidazole under microwave irradiation. |
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性质
| Assay【测定】 | 97% |
| mp | 26-30 ℃ (lit.) |
| SMILES string | CCOC(=O)c1ccc(Cl)nc1 |
| InChI | 1S/C8H8ClNO2/c1-2-12-8(11)6-3-4-7(9)10-5-6/h3-5H,2H2,1H3 |
| InChI key | ILDJJTQWIZLGPO-UHFFFAOYSA-N |
| packaging【包装】 | 25 g in glass bottle |
安全信息
| Pictograms【象形图】 | GHS07 |
| Signal word【警示用语：】 | Warning |
| Hazard Statements | H315 - H319 |
| Precautionary Statements | P302 + P352 - P305 + P351 + P338 |
| Hazard Classifications【危险分类】 | Eye Irrit. 2 - Skin Irrit. 2 |
| Storage Class Code【储存分类代码】 | 11 - Combustible Solids |
| WGK | WGK 3 |
| Flash Point(F)【闪点(F)】 | 230.0 °F - closed cup |
| Flash Point(C)【闪点(C)】 | 110 ℃ - closed cup |
| Personal Protective Equipment【个人防护装备】 | dust mask type N95 (US), Eyeshields, Gloves |
