2-Fluoro-4-(Hydroxymethyl)Benzonitrile 2-氟-4-(羟甲基)苄甲腈

CAS 222978-02-1 MFCD08236861

化学结构图

222978-02-1
SMILES: N#CC1C=CC(CO)=CC=1F

化学属性

Mol. FormulaC8H6FNO
Mol. Weight151.14
Melting Point66-68°

别名和识别编码

Chemical Name2-Fluoro-4-(Hydroxymethyl)Benzonitrile
CAS Number222978-02-1
Alfabeta NameFLUOROHYDROXYMETHYLBENZENECARBONITRILE 24()---
MDL NumberMFCD08236861
Synonym 2-fluoro-4-(hydroxymethyl)benzonitrile
PubChem Substance ID329791107
Chemical Name Translation2-氟-4-(羟甲基)苄甲腈
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分类

  • {KO} Nitriles
  • {KO} Alcohols
  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C7-C8, Chemical Synthesis, Fluorinated Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks

安全信息

Warnings IRRITANT
WGK Germany3

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
1
H-bond Acceptors
2
Rotatable Bonds
1
LogP
1

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Fluorinated Building Blocks 氟化物砌块
  4. Organic Fluorinated Building Blocks - Fluorinated Building Blocks
  5. Other Fluorinated Organic Building Blocks - Organic Fluorinated Building Blocks
  6. Aryl Fluorinated Building Blocks 芳基氟化物
  7. C7-C8 - Aryl Fluorinated Building Blocks
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物

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