1-[3-(4-Chlorophenyl)-5-isoxazolyl]-1-ethanol 1-[3-(4-氯苯基)-5-异恶唑基]-1-乙醇

CAS 109572-24-9 MFCD03425717

化学结构图

109572-24-9
SMILES: CC(O)C1=CC(=NO1)C1C=CC(Cl)=CC=1

化学属性

Mol. FormulaC11H10ClNO2
Mol. Weight223.66
Melting Point63-67°

别名和识别编码

Chemical Name1-[3-(4-chlorophenyl)-5-isoxazolyl]-1-ethanol
Alfabeta NameCHLOROPHENYLISOXAZOLYLETHANOL 13451[]()-------
MDL NumberMFCD03425717
Synonym 1-[3-(4-chlorophenyl)-5-isoxazolyl]-1-ethanol
CAS Number109572-24-9
PubChem Substance ID329790842
Chemical Name Translation1-[3-(4-氯苯基)-5-异恶唑基]-1-乙醇
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分类

  • {KO} Alcohols
  • {SNA} Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Isoxazoles

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P305+P351+P338
Signal word Warning
Safety Statements
  • 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；
Hazard Codes Xn
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛

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
3
Rotatable Bonds
2
H-bond Donors
1
LogP
2

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Halogenated Heterocycles 卤代杂环
  5. Isoxazoles - Halogenated Heterocycles

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