Methyl 5-cyano-2-hydroxybenzoate 5-氰基-2-羟基苯甲酸甲酯

CAS 84437-12-7 MFCD00800949

化学结构图

84437-12-7
SMILES: COC(=O)C1=CC(=CC=C1O)C#N

化学属性

Mol. FormulaC9H7NO3
Mol. Weight177

别名和识别编码

Chemical NameMethyl 5-cyano-2-hydroxybenzoate
CAS Number84437-12-7
Alfabeta NameMETHYLCYANOHYDROXYBENZENECARBOXYLATE 52---
MDL NumberMFCD00800949
Synonym methyl 5-cyano-2-hydroxy-benzate
Chemical Name Translation5-氰基-2-羟基苯甲酸甲酯
PubChem Substance ID329782350
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分类

  • {KO} Nitriles
  • {SNA} Building Blocks, C8 to C9, C9, C9 to C20+, Chemical Synthesis, Cyanides/Nitriles, Ethers, Nitrogen Compounds, Organic Building Blocks, Oxygen Compounds, Phenols
  • {KO} ArylOHs
  • {KO} Esters
  • Building Blocks, C8 to C9, C9,

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Signal word Warning
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 Donors
1
H-bond Acceptors
4
Rotatable Bonds
2
LogP
1

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Phenols 酚类
  6. C9 to C20+ - Phenols

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