3-Bromoindole-2-Carboxylic Acid 3-溴吲哚-2-甲酸

CAS 28737-33-9 MFCD02710285

化学结构图

28737-33-9
SMILES: OC(=O)C1NC2C=CC=CC=2C=1Br

化学属性

Mol. FormulaC9
Mol. Weight240
Melting Point201-203°

别名和识别编码

Chemical Name3-Bromoindole-2-Carboxylic Acid
CAS Number28737-33-9
Alfabeta NameBROMOINDOLECARBOXYLICACID H312-----
MDL NumberMFCD02710285
Synonym 3-bromoindole-2-carboxylic acid
Chemical Name Translation3-溴吲哚-2-甲酸
PubChem Substance ID329783604
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分类

  • {KO} AminesSecondaryHeteroNH
  • {KO} ReacBromides
  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C7 to C9, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
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 statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Hazard Codes Xn
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害

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 Donors
2
H-bond Acceptors
2
Rotatable Bonds
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. Indoles 吲哚
  5. C7 to C9 - Indoles
  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. Heterocyclic Acids 杂环酸
  5. Indole Acids

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