143262-11-7 (tert-butyl 5-methoxyindoline-1-carboxylate,Tert-butyl 5-methoxyindoline-1-carboxylate)

CAS号:
143262-11-7
中文名称:
tert-butyl 5-methoxyindoline-1-carboxylate
英文名称:
Tert-butyl 5-methoxyindoline-1-carboxylate
分子式:
C14H19NO3
分子量:
249.305564165115

tert-butyl 5-methoxyindoline-1-carboxylate(143262-11-7)名称与标识符

名称

中文别名:
5-甲氧基吲哚啉-1-羧酸叔丁酯;
英文别名:
tert-butyl 5-methoxyindoline-1-carboxylate;JXRHJQZYRSELDB-UHFFFAOYSA-N;1-(tert-Butoxycarbonyl)-5-methoxyindoline;tert-butyl 5-methoxy-2,3-dihydro-1H-indole-1-carboxylate;2,3-Dihydro-1-(tert-butoxycarbonyl)-5-methoxy-1H-indole;1h-indole-1-carboxylic acid,2,3-dihydro-5-methoxy-,1,1-dimethylethyl ester;

标识符

InChIKey:
JXRHJQZYRSELDB-UHFFFAOYSA-N
Inchi:
1S/C14H19NO3/c1-14(2,3)18-13(16)15-8-7-10-9-11(17-4)5-6-12(10)15/h5-6,9H,7-8H2,1-4H3
SMILES:
O(C(N1C2C=CC(=CC=2CC1)OC)=O)C(C)(C)C

tert-butyl 5-methoxyindoline-1-carboxylate(143262-11-7)物化性质

计算特性

  • 氢键供体数量 : 0
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 3
  • 重原子数量 : 18
  • 复杂度 : 311
  • 疏水参数计算参考值(XlogP) : 2.7
  • 拓扑分子极性表面积 : 38.8