uspto-grants-2011_01 · 10.6084/m9.figshare.5104873.v1 · US07863302B2
查看IDENTITY
结构与身份
- 标准SMILES
- COC(=O)c1cc2ccc(Br)cc2n1C
- InChIKey
- RCDWEKOOOHATJC-UHFFFAOYSA-N
- 分子式
- C11H10BrNO2
- 平均分子量
- 268.11 g/mol
- 单同位素质量
- 266.98949
COMPUTED
结构计算性质
- XLogP
- 2.9
- 极性表面积
- 31.2 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 2
- 重原子
- 15
- 形式电荷
- 0
- 复杂度
- 259
ALIASES
名称与别名
680569-18-0METHYL 6-BROMO-1-METHYL-1H-INDOLE-2-CARBOXYLATEmethyl 6-bromo-1-methylindole-2-carboxylateMFCD07364734Methyl 6-bromo-1-methyl-indole-2-carboxylateSCHEMBL20823746-Bromo-1-methyl-1H-indole-2-carboxylic acid methyl esterRCDWEKOOOHATJC-UHFFFAOYSA-NAKOS004119402FM57000AS-67825SY126333DB-370962CS-0131938W12836F095634Methyl 6-broMo-1-Methylindole-2-carboxylate, 97%
REACTIONS