6-(Ethylsulfonyl)-2-(2-hydroxyethyl)-2H-1,4-benzoxazin-3(4H)-one

CAS N/A MFCD05974884

化学结构图

N/A
SMILES: CCS(=O)(=O)C1C=C2NC(=O)C(CCO)OC2=CC=1

化学属性

Mol. FormulaC12H15NO5S
Mol. Weight285.32
Melting Point145-147°

别名和识别编码

Chemical Name6-(Ethylsulfonyl)-2-(2-hydroxyethyl)-2H-1,4-benzoxazin-3(4H)-one
Alfabeta NameETHYLSULFONYLHYDROXYETHYLBENZOXAZINONE HH62221434((()))---------,
MDL NumberMFCD05974884
Synonym 6-(Ethylsulfonyl)-2-(2-hydroxyethyl)-2H-1,4-benzoxazin-3(4H)-one
PubChem Substance ID329790797
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分类

  • {KO} AminesSecondaryHeteroNH
  • {KO} Alcohols
  • {SNA} Alcohols, Amines, Building Blocks, C11 to C30+, C12, Chemical Synthesis, Ethers, Nitrogen Compounds, Organic Building Blocks, Oxygen Compounds

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
  • H319 Causes serious eye irritation 严重刺激眼睛
Hazard Codes Xi
Risk Statements
  • R36 Irritating to eyes 刺激眼睛

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Donors
2
H-bond Acceptors
5
Rotatable Bonds
4
LogP
-3.560000000000000e-001

系列性分类

  1. C12 - Amines
  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. C13 to C14 - Ethers
  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. Alcohols - Oxygen Compounds
  6. C11 to C30+ - Alcohols

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