HCID762965

Methyl 3-formyl-1H-indole-7-carboxylate

C11H9NO3203.19 g/molCAS 312973-24-3

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: COC(=O)c1cccc2c(C=O)c[nH]c12
InChIKey: JVUPHJBFLSMOGY-UHFFFAOYSA-N
分子式: C11H9NO3
平均分子量: 203.19 g/mol
单同位素质量: 203.05824315

COMPUTED

结构计算性质

等待补全

XLogP: 1.4
极性表面积: 59.2 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 3
重原子: 15
形式电荷: 0
复杂度: 267

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 27 条

methyl 3-formyl-1H-indole-7-carboxylate312973-24-3DTXSID30354083RefChem:355004DTXCID80305146887-570-13-FORMYLINDOLE-7-CARBOXYLIC ACID METHYL ESTERMFCD00550641methyl 3-formylindole-7-carboxylatemethyl3-formyl-1H-indole-7-carboxylateOprea1_663245SCHEMBL5415543JVUPHJBFLSMOGY-UHFFFAOYSA-NAKOS0015930237-methoxycarbonyl-3-indolcarboxaldehydeCS-W006760PB42511DS-18196SY097851DB-022579

REACTIONS

参与反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

查看

uspto-grants-2007_12 · 10.6084/m9.figshare.5104873.v1 · US07312342B2

查看

uspto-grants-2007_12 · 10.6084/m9.figshare.5104873.v1 · US07312342B2

查看

uspto-grants-2006_05 · 10.6084/m9.figshare.5104873.v1 · US07049312B1

查看