5-Ethyl-2-(2-Hydroxyethyl)Pyridine 5-乙基-2-(2-羟基乙基)吡啶

CAS 5223-06-3 MFCD00129040

化学结构图

5223-06-3
SMILES: CCc1ccc(CCO)nc1

化学属性

Mol. FormulaC9H13NO
Mol. Weight151.21
Boiling Point259.4°C at 760 mmHg
Melting Point39-44
Density1.037
TSCANo

别名和识别编码

Chemical Name5-Ethyl-2-(2-Hydroxyethyl)Pyridine
CAS Number5223-06-3
Alfabeta NameETHYLPYRIDINYLETHANOL 2521()------
MDL NumberMFCD00129040
Synonym 2-(5-Ethylpyridin-2-yl)ethanol {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(5-Ethylpyridin-2-yl)ethanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2
EC Number226-024-3
Beilstein Registry Number117340
Chemical Name Translation5-乙基-2-(2-羟基乙基)吡啶
Reaxys-RN117340
PubChem Substance ID78894
Wiswesser Line NotationT6NJ B2Q E2
LabNetwork Molecule IDLN00147945
InChIInChI=1S/C9H13NO/c1-2-8-3-4-9(5-6-11)10-7-8/h3-4,7,11H,2,5-6H2,1H3
Canonical SMILESCCC1=CN=C(CCO)C=C1
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分类

  • {SNA} Building Blocks, C9, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines
  • Bases & Related Reagents
  • {KO} Alcohols
  • Aromatics
  • Nucleotides

产品应用

  • 重要的有机中间体,主要用于治疗Ⅱ型糖尿病药品吡格列酮的中间原料。

相关文献及参考

  • Beilstein:21(5)2,260

安全信息

Warnings IRRITANT
Signal word Danger Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S000926
  • 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;
Risk Statements
  • R000921
  • R21 Harmful in contact with skin 与皮肤接触有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Precautionary statements
  • 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。
  • P264+P265
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P302+P352
  • P302+P352+P312+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P305+P354+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P317
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P322 Specific measures (see …on this label). 具体治疗(见本标签上的)。
  • P332+P313
  • P337+P313
  • P337+P317
  • P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
  • P362+P364
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
RTECSUT3150000
Hazard statements
  • H303 May be harmfully swallowed 吞食可能有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H318 Causes serious eye damage 严重伤害眼睛
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 4290 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIHAAP American Industrial Hygiene Association Journal.  (AIHA, 475 Wolf
   Ledges Pkwy., Akron, OH 44311)  V.19-    1958-  Volume(issue)/page/year:
   23,95,1962

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 1780 uL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIHAAP American Industrial Hygiene Association Journal.  (AIHA, 475 Wolf
   Ledges Pkwy., Akron, OH 44311)  V.19-    1958-  Volume(issue)/page/year:
   23,95,1962

Hazard Codes Xi
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
2
Rotatable Bonds
3
H-bond Donors
1
LogP
1

其他信息

  • 5-乙基-2-吡啶乙醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 E0562 5-乙基-2-吡啶乙醇 5-Ethyl-2-pyridineethanol 5G 588元 2014/06/02 E0562 5-乙基-2-吡啶乙醇 5-Ethyl-2-pyridineethanol 25G 1710元 2010/05/25 L19482 5-乙基-2-(2-羟基乙基)吡啶, 98% 5-Ethyl-2-(2-hydroxyethyl)pyridine, 98% 5g 584元
  • 外观性质:无色或淡黄色液体。沸点:127°C
  • TCI Shanghai:5-乙基-2-吡啶乙醇 5-Ethyl-2-pyridineethanol,>;97.0%(GC)(5223-06-3)
  • 用途一:用作医药中间体
  • Alfa Aesar:5-乙基-2-(2-羟基乙基)吡啶,98% 5-Ethyl-2-(2-hydroxyethyl)pyridine, 98%(5223-06-3)
  • 用途二:重要的有机中间体,主要用于治疗Ⅱ型糖尿病药品吡格列酮的中间原料。
  • MOL 文件:5223-06-3.mol
  • 上游原料:乙醇 --> 三氯甲烷 --> 甲酸 --> 多聚甲醛 --> 对叔丁基邻苯二酚 --> 5-乙基-2-甲基-吡啶

系列性分类


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