1,4-dioxa-9-thia-12-azadispiro[4.2.4.2]tetradecane-11-carboxylic acid

CAS 1030253-98-5 MFCD06411612

化学结构图

1030253-98-5
SMILES: OC(=O)C1CSC2(CCC3(CC2)OCCO3)N1

化学属性

Mol. FormulaC11
Mol. Weight259
Melting Point201°

别名和识别编码

Chemical Name1,4-dioxa-9-thia-12-azadispiro[4.2.4.2]tetradecane-11-carboxylic acid
Alfabeta NameDIOXATHIAAZADISPIROTETRADECANECARBOXYLICACID 14912424211...[]--------,
MDL NumberMFCD06411612
CAS Number1030253-98-5
Synonym 1,4-dioxa-9-thia-12-azadispiro[4.2.4.2]tetradecane-11-carboxylic acid
Chemical Name Translation
PubChem Substance ID329791476
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分类

  • {KO} AminesSecondaryHeteroNH
  • {KO} CarboxylicAcids
  • {SNA} Amines, Building Blocks, C11, Chemical Synthesis, Ethers, Nitrogen Compounds, Organic Building Blocks, Oxygen Compounds

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P301+P310
Signal word Danger
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Hazard Codes T
Risk Statements
  • R25 Toxic if swallowed 吞咽有毒

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
1
LogP
9.868000000000000e-001

系列性分类


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