Ethyl 2-cyano-3-(2-thienyl)acrylate

CAS 31330-51-5 MFCD00039684

化学结构图

31330-51-5
SMILES: CCOC(=O)/C(=C/C1=CC=CS1)/C#N

化学属性

Mol. FormulaC10H9NO2S
Mol. Weight207
Melting Point79-82°

别名和识别编码

Chemical Name2-Thiopheneacrylic acid, alpha-cyano-, ethyl ester
CAS Number31330-51-5
Alfabeta NameETHYLCYANOTHIENYLACRYLATE 232()----
MDL NumberMFCD00039684
Synonym alpha-Cyano-2-thiopheneacrylic acid ethyl ester
Wiswesser Line NotationT5SJ B1UYCN&VO2
Beilstein Registry Number0163675
Chemical Name Translation
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信息真实价格透明    资金保障    专业采购外包团队在线服务   
品牌质保精细包装    现货库存    一流品牌服务   

分类

  • {KO} Nitriles
  • {KO} Esters

安全信息

Warnings IRRITANT
RTECSXM7800000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#02961

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Donors
0
H-bond Acceptors
3
Rotatable Bonds
5
LogP
1

系列性分类

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