4,5-Dimethyl-1H-pyrrole-3-propionic acid (CAS 52091-04-0) — formula C9H13NO2, molecular weight 167.20; category organic chemicals.
4,5-Dimethyl-1H-pyrrole-3-propionic acid is a carbon-based organic compound with CAS registry number 52091-04-0 and molecular formula C9H13NO2 (molecular weight 167.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 52091-04-0
Its molecular formula C9H13NO2 comprises 9 C, 13 H, 1 N, 2 O atoms.
Also known as: 4,5-Dimethyl-1H-pyrrole-3-propionic acid · 4,5-二甲基-1H-吡咯-3-丙酸
Category: organic chemicals
The CAS registry number of 4,5-Dimethyl-1H-pyrrole-3-propionic acid is 52091-04-0.
Molecular formula C9H13NO2, molecular weight 167.20.
It is also registered under: 4,5-Dimethyl-1H-pyrrole-3-propionic acid, 4,5-二甲基-1H-吡咯-3-丙酸.
Category: Organic Chemicals.
Public-database records for 4,5-Dimethyl-1H-pyrrole-3-propionic acid (CAS 52091-04-0), reproduced here for independent cross-checking.
| CAS 号 | 52091-04-0 |
|---|---|
| PubChem CID | 44718691 |
| 分子式 | C9H13NO2 |
| IUPAC 名称 | 3-(4,5-dimethyl-1H-pyrrol-3-yl)propanoic acid |
SCHEMBL1171886; 2,3-dimethyl-pyrrole-4-propionic acid; 52091-04-0; DB-305261; 4,5-Dimethyl -1h-pyrrole-3-propionic acid
| 分子量 | 167.20 |
|---|---|
| XLogP3 | 1.2 |
| 氢键供体数 | 2 |
| 氢键受体数 | 2 |
| 可旋转键数 | 3 |
| 精确质量 | 167.094628657 |
| 单同位素质量 | 167.094628657 |
| 拓扑极性表面积 | 53.1 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
4,5-二甲基-1H-吡咯-3-丙酸 · CAS 52091-04-0 · C9H13NO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.