205448-74-4 (4-Chloro-7-methoxy-6-quinolinol,4-Chloro-7-methoxyquinolin-6-ol)

CAS号:
205448-74-4
中文名称:
4-Chloro-7-methoxy-6-quinolinol
英文名称:
4-Chloro-7-methoxyquinolin-6-ol
分子式:
C10H8ClNO2
分子量:
209.629021644592

4-Chloro-7-methoxy-6-quinolinol(205448-74-4)名称与标识符

名称

中文别名:
4-Chloro-7-methoxy-6-quinolinol;
英文别名:
4-chloro-7-methoxy-6-quinolinol;6-Chlor-2-(methylmercapto)-pyrimidin-ol-(4);4-chloro-7-methoxyquinolin-6-ol;CTK5C4248;4-Chlor-6-hydroxy-2-methylmercapto-pyrimidin;MLS000736609;NSC45719;AC1Q3H9T;6-Chlor-4-hydroxy-2-methylthio-pyrimidin;4-chloro-6-hydroxy-2-methylthiopyrimidine;AR-1H1228;2-Methylthio-4-chlor-6-hydroxy-pyrimidin;6-chloro-2-(methylsulfanyl)pyrimidin-4(1h)-one;6-chloro-2-(methylthio)pyrimidin-4-ol;AC1L6428;4-chloro-7-methoxy-quinolin-6-ol;6-chloro-2-methylsulfanyl-3H-pyrimidin-4-one;4-chloro-6-hydroxy-7-methoxyquinoline;HMS2886K13;6-Chlor-2-(methylmercapto)-pyrimidin-ol-(4); 4-chloro-7-methoxyquinolin-6-ol; CTK5C4248; 4-Chlor-6-hydroxy-2-methylmercapto-pyrimidin; MLS000736609; NSC45719; AC1Q3H9T; 6-Chlor-4-hydroxy-2-methylthio-pyrimidin; 4-chloro-6-hydroxy-2-methylthiopyrimidine; AR-1H1228; 2-Methylthio-4-chlor-6-hydroxy-pyrimidin; 6-chloro-2-(methylsulfanyl)pyrimidin-4(1h)-one; 6-chloro-2-(methylthio)pyrimidin-4-ol; AC1L6428; 4-chloro-7-methoxy-quinolin-6-ol; 6-;GXGHEFVSWVGPAO-UHFFFAOYSA-N;AC9481;SY263594;SCHEMBL2064039;MFCD18073186;CS-0436849;DB-123428;6-Quinolinol, 4-chloro-7-methoxy-;205448-74-4;

标识符

MDL:
MFCD18073186
InChIKey:
GXGHEFVSWVGPAO-UHFFFAOYSA-N
Inchi:
1S/C10H8ClNO2/c1-14-10-5-8-6(4-9(10)13)7(11)2-3-12-8/h2-5,13H,1H3
SMILES:
ClC1C=CN=C2C=C(C(=CC2=1)O)OC

4-Chloro-7-methoxy-6-quinolinol(205448-74-4)物化性质

实验特性

  • PSA : 42.35

计算特性

  • 精确分子量 : 209.02444
  • 氢键供体数量 : 1
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 1
  • 同位素质量 : 209.0243562g/mol
  • 重原子数量 : 14
  • 复杂度 : 203
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 2.4
  • 拓扑分子极性表面积 : 42.4Ų

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