Ethyl Piperidine-4-carboxylate 哌啶-4-甲酸乙酯
CAS 1126-09-6 MFCD00006003
化学结构图
SMILES: CCOC(=O)C1CCNCC1
化学属性
| Mol. Formula | C8 |
|---|---|
| Mol. Weight | 157 |
| Density | 1.02 g/mL at 25 °C(lit.) |
| Refractive index | 1.4580 to 1.4610 |
| Boiling Point | 105°C/10mmHg(lit.) |
| Flash Point | 80°C(lit.) |
| TSCA | No |
| Solubility | MISCIBLE |
| Melting Point | 203-205°C |
| Appearance | 4-哌啶甲酸乙酯(1126-09-6)为无色或浅黄色透明液体。沸点 204℃，密度:1.0200 闪点 176F （80℃），折光率N D 20 :1.4591,微溶于水,易溶于乙醇、氯仿、甲苯等有机溶剂。 |
| pH | :A |
别名和识别编码
| Chemical Name | Ethyl Piperidine-4-carboxylate |
|---|---|
| CAS Number | 1126-09-6 |
| Alfabeta Name | ETHYLPIPERIDINECARBOXYLATE 4-- |
| MDL Number | MFCD00006003 |
| EC Number | 214-416-7 |
| Beilstein Registry Number | 118419 |
| Synonym | H-DL-Inp-OEt ISONIPECOTIC ACID ETHYL ESTER Ethyl 4-Piperidinecarboxylate (Ethyl isonipecotate) 4-哌啶甲酸乙酯 Piperidin-4-carboxylic acid ethyl ester 哌啶-4-甲酸乙酯 异哌啶酸乙酯 4-Carbethoxypiperidine TIMTEC-BB SBB004006 哌啶-4-羧酸乙酯 4-哌啶甲酸乙酯; ETHYL PIPERIDINE-4-CARBOXYLATE 4-PIPERDINECARBOXYLIC ACID, ETHYL ESTER LABOTEST-BB LT00159543 六氢异烟酸乙酯 4-PIPERIDINECARBOXYLIC ACID ETHYL ESTER ETHYL 4-PIPERIDINECARBOXYLATE 4-哌啶甲酸乙酯 AKOS MSC-0737 RARECHEM AH CK 0180 ISONIPECOTINIC ACID ETHYL ESTER ETHYL ISONIPECOTATE Ethyl Isonipecotate(ethyl 4-Piperidinecarboxylate) Ethyl isonipecotate, 98+% Ethyl 4-piperidinecarboxylate; Ethyl piperidine-4-carboxylate Ethyl piperidine-4-carboxylate ethylpiperidine-2-carboxylate（hydrochloride Ethyl piperidine-4-carboxylate 97% PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER Hexahydroisonicotinic acid, ethyl ester |
| PubChem Substance ID | 87571654 |
| Chemical Name Translation | 哌啶-4-甲酸乙酯 |
| Reaxys-RN | 118419 |
| InChIKey | RUJPPJYDHHAEEK-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00008672 |
| InChI | InChI=1S/C8H15NO2/c1-2-11-8(10)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3 |
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分类
- {SNA} Building Blocks, C8, Chemical Synthesis, Heterocyclic Building Blocks, Piperidines
产品应用
- Reactant for synthesis of SMN protein modulators and β-aryl and β-amino-substituted aliphatic esters by rhodium catalyzed tandem double bond migration/conjugate addition.
安全信息
GHS Symbol
- S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
- S37 Wear suitable gloves 戴适当手套；
- S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
- S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾；
- S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- R34 Causes burns 会导致灼伤
- P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
- P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P305+P351+P338
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P332+P313
- P370+P378
- P305+P351+P338+P337+P313
- P302+P350
- P337+P313
- P302+P352+P332+P313+P362+P364
- P403+P235
- H227 Combustible liquid 可燃液体
其他信息
- Alfa Aesar:哌啶-4-羧酸乙酯,98% Ethyl isonipecotate, 98%(1126-09-6)
- 用途一:用于有机合成、药物合成
- 图谱信息:4-哌啶甲酸乙酯(1126-09-6)红外图谱(IR1) 4-哌啶甲酸乙酯(1126-09-6)核磁图( 1 HNMR) 4-哌啶甲酸乙酯(1126-09-6)红外图谱(IR2) 4-哌啶甲酸乙酯(1126-09-6)核磁图( 13 CNMR) 4-哌啶甲酸乙酯(1126-09-6)质谱(MS)
- TCI Shanghai:4-哌啶甲酸乙酯 Ethyl Isonipecotate,>;97.0%(GC)(1126-09-6)
- Sigma Aldrich:1126-09-6(sigmaaldrich)
- MOL 文件:1126-09-6.mol
- MSDS 信息:Ethyl 4-piperidinecarboxylate(1126-09-6).msds
- 4-哌啶甲酸乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0294 异哌啶酸乙酯 Ethyl 4-Piperidinecarboxylate 500ML 2690元 2014/06/02 I0294 异哌啶酸乙酯 Ethyl 4-Piperidinecarboxylate 25ML 326元 2010/06/21 118641000 4-哌啶甲酸乙酯 Ethyl isonipecotate 98+% 100 GR 1143元
- Hazard Note:Irritant
- 海关编码:29333999
- Acros Organics:哌啶-4-羧酸乙酯 Ethyl isonipecotate, 98+%(1126-09-6)
- 下游产品:S-3-氨基奎宁环胺盐酸盐 --> 3-氨基奎宁环盐酸盐 --> N-Boc-4-甲基-4-哌啶甲酸乙酯 --> (R)-(-)-3-奎宁醇 --> R-3-氨基奎宁环二盐酸盐 --> 3-奎宁环酮盐酸盐 --> 1-BOC-4-乙基-4-哌啶甲酸 --> 1-Boc-4-甲基-4-哌啶甲酸 --> 2-(4-乙氧基羰基哌啶-1-基)嘧啶-5-甲酸乙酯 --> (R)-3-奎宁环醇盐酸盐 --> 2-(4-乙氧基羰基哌嗪-1-基)-6-三氟甲基嘧啶-4-甲酸乙酯 --> (S)-(+)-3-喹宁醇 --> 1-(2-氯乙酰基)-4-哌啶甲酸乙酯
- 检测方法:HPLC,GC,NMR
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