[2-(Methylthio)phenoxy]acetic Acid [2-(甲硫基)苯氧基]乙酸

CAS 3395-40-2 MFCD09972274

化学结构图

3395-40-2
SMILES: CSc1ccccc1OCC(=O)O

化学属性

Mol. FormulaC9H10O3S
Mol. Weight198.24
Melting Point167-168 °C
Boiling Point345.7±22.0 °C at 760 mmHg

别名和识别编码

Chemical Name[2-(Methylthio)phenoxy]acetic Acid
CAS Number3395-40-2
Alfabeta NameMETHYLSULFANYLPHENOXYACETICACID 22[]()--
MDL NumberMFCD09972274
Synonym 2-(2-(Methylthio)phenoxy)acetic acid {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2-(Methylthio)phenoxy)acetic a
Chemical Name Translation[2-(甲硫基)苯氧基]乙酸
PubChem Substance ID20086037
LabNetwork Molecule IDLN00151342
InChIInChI=1S/C9H10O3S/c1-13-8-5-3-2-4-7(8)12-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
Canonical SMILESCSC1=CC=CC=C1OCC(=O)O
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分类

  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C9, Chemical Synthesis, Ethers, Organic Building Blocks, Oxygen Compounds

相关文献及参考

安全信息

Warnings IRRITANT
WGK Germany3
Storage condition

药物吸收、分布、代谢与排泄(ADME)

H-bond Acceptors
3
Rotatable Bonds
4
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. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Ethers - Oxygen Compounds
  6. C9 - Ethers

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