6-(4-Methylphenyl)-2-oxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid

CAS N/A MFCD03425706

化学结构图

N/A
SMILES: CC1C=CC(=CC=1)C1C=C(NC(=O)N1)C(O)=O

化学属性

Mol. FormulaC12H12N2O3
Mol. Weight232.24
Melting Point248-250°

别名和识别编码

Chemical Name6-(4-methylphenyl)-2-oxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid
Alfabeta NameMETHYLPHENYLOXOTETRAHYDROPYRIMIDINECARBOXYLICACID 64212364()--------,,,
MDL NumberMFCD03425706
Synonym
PubChem Substance ID329789188
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分类

  • {KO} CarboxylicAcids
  • {SNA} Amines, Building Blocks, C12, Chemical Synthesis, Nitrogen Compounds, Organic Building Blocks

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 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
2
H-bond Donors
3
LogP
7.210000000000000e-001

系列性分类

  1. C12 - Amines
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Heterocyclic Acids 杂环酸
  5. Pyrimidine Acids

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