2-Chloro-6-Methoxynicotinic Acid 2-氯-6-甲氧基烟酸

CAS 503000-87-1 MFCD08236845

化学结构图

503000-87-1
SMILES: COC1=CC=C(C(O)=O)C(Cl)=N1

化学属性

Mol. FormulaC7H6ClNO3
Mol. Weight187.58
Melting Point230 (°C)

别名和识别编码

Chemical Name2-Chloro-6-Methoxynicotinic Acid
CAS Number503000-87-1
Alfabeta NameCHLOROMETHOXYNICOTINICACID 26---
MDL NumberMFCD08236845
Synonym 2-Chloro-6-methoxynicotinic acid
PubChem Substance ID329771663
Chemical Name Translation2-氯-6-甲氧基烟酸
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分类

  • {KO} ReacChlorides
  • Building Blocks, C7 to C18, C7 to C8, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyridines
  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C7, C7 to C8, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyridines

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Signal word Warning
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
2
H-bond Donors
1
LogP
1

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. Pyridines - Halogenated Heterocycles
  6. C7 to C18 - Pyridines
  1. C7 to C8 - Pyridines

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