1-Isopropyl-4-piperidone 1-(1’-甲基乙基)-4-哌啶酮
CAS 5355-68-0 MFCD00038035
化学结构图
SMILES: CC(C)N1CCC(=O)CC1
化学属性
| Mol. Formula | C8H15NO |
|---|---|
| Mol. Weight | 141.21 |
| Density | 0.95 |
| Refractive index | 1.4630 to 1.4670 |
| TSCA | No |
| Boiling Point | 213.6°C at 760 mmHg |
| Flash Point | 100-101°C/27mm |
| Melting Point | 105-105.5 °C |
别名和识别编码
| Chemical Name | 1-Isopropyl-4-piperidone |
|---|---|
| Synonym | 1-Isopropyl-4-piperidone {LY} 1-Isopropyl-4-piperidone {} {LY} 1-Isopropyl-4-piperidone {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Isopropyl-4-piperidone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { |
| MDL Number | MFCD00038035 |
| CAS Number | 5355-68-0 |
| EC Number | 226-339-6 |
| Beilstein Registry Number | 107857 |
| Alfabeta Name | ISOPROPYLPIPERIDONE 14--- |
| Reaxys-RN | 107857 |
| PubChem Substance ID | 79313 |
| Chemical Name Translation | 1-(1’-甲基乙基)-4-哌啶酮 |
| InChIKey | CCDBCHAQIXKJCG-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00185280 |
| InChI | InChI=1S/C8H15NO/c1-7(2)9-5-3-8(10)4-6-9/h7H,3-6H2,1-2H3 |
| Canonical SMILES | CC(N1CCC(CC1)=O)C |
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分类
- {uni_hamburg} no charge; nitrogen heterocycle; alicycle; 6RingOnly; 6ring; ketone; 1fragment
相关文献及参考
- Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15
- Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
安全信息
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- 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；
- 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；
- S37 Wear suitable gloves 戴适当手套；
- S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
- H227 Combustible liquid 可燃液体
- 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。
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- 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。
- P304+P340
- P305+P351+P338
- P332+P313
- 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
- P370+P378
- P405 Store locked up. 上锁保管。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- P501a
GHS Symbol
其他信息
- Acros Organics:1-（1'-甲基乙基）-4-哌啶酮 1-(1'-Methylethyl)-4-piperidone, 99%(5355-68-0)
- 上游原料:异丙胺 --> 6-苄氨基嘌呤
- 方法一:以异丙胺、丙烯酸酯经加成、狄克曼缩合，然后水解、脱羧制得该品。
- Alfa Aesar:1-异丙基-4-哌啶酮,99% 1-Isopropyl-4-piperidone, 99%(5355-68-0)
- Sigma Aldrich:5355-68-0(sigmaaldrich)
- MOL 文件:5355-68-0.mol
- 1-异丙基-4-哌啶酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 I0566 1-异丙基-4-哌啶酮 1-Isopropyl-4-piperidone 25G 545元 2010/06/21 134101000 1-异丙基-4-哌啶酮 1-(1'-Methylethyl)-4-piperidone 99% 100 ML 1070元 2010/06/21 134100050 1-异丙基-4-哌啶酮 1-(1'-Methylethyl)-4-piperidone 99% 5 ML 400元
- MSDS 信息:1-Isopropyl-4-piperidone(5355-68-0).msds
- 1-异丙基-4-哌啶酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0566 1-异丙基-4-哌啶酮 1-Isopropyl-4-piperidone 25G 558元 2010/06/21 134101000 1-异丙基-4-哌啶酮 1-(1'-Methylethyl)-4-piperidone 99% 100 ML 1070元 2010/06/21 134100050 1-异丙基-4-哌啶酮 1-(1'-Methylethyl)-4-piperidone 99% 5 ML 400元
- TCI Shanghai:1-异丙基-4-哌啶酮 1-Isopropyl-4-piperidone,>;97.0%(T)(5355-68-0)
- 下游产品:洛开酰胺 --> N-(4-氯苯基)-1-(1-甲基乙基)-4-哌啶胺 --> 4-氯-N-[1-(1-甲基乙基)-4-亚哌啶基]苯胺
