1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,4-methylester(9CI) (CAS 50296-60-1) — formula C9H11NO4, molecular weight 197.19; category organic chemicals.
| CAS Number | 50296-60-1 |
|---|---|
| Molecular Formula | C9H11NO4 |
| Molecular Weight | 197.19 |
| LogP | 1.2 |
| Category | Organic Chemicals |
1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,4-methylester(9CI) is a carbon-based organic compound with CAS registry number 50296-60-1 and molecular formula C9H11NO4 (molecular weight 197.19), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 50296-60-1
Its molecular formula C9H11NO4 comprises 9 C, 11 H, 1 N, 4 O atoms.
Also known as: 1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,4-methylester(9CI) · 1H-吡咯-2,4-二甲酸,3,5-二甲基-,4-甲酯(9Cl)
Category: organic chemicals
The CAS registry number of 1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,4-methylester(9CI) is 50296-60-1.
Molecular formula C9H11NO4, molecular weight 197.19.
It is also registered under: 1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,4-methylester(9CI), 1H-吡咯-2,4-二甲酸,3,5-二甲基-,4-甲酯(9Cl).
Category: Organic Chemicals.
Independent reference data for 1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,4-methylester(9CI) (CAS 50296-60-1), compiled from public chemistry databases.
| CAS 号 | 50296-60-1 |
|---|---|
| PubChem CID | 142700 |
| 分子式 | C9H11NO4 |
| IUPAC 名称 | 4-methoxycarbonyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid |
| UNII（FDA） | HMS1766M15 |
| Molecular Weight | 197.19 |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 197.06880783 |
| Monoisotopic Mass | 197.06880783 |
| Topological Polar Surface Area | 79.4 |
| Heavy Atom Count | 14 |
50296-60-1; 4-(methoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid; 3,5-Dimethyl-1H-pyrrole-2,4-dicarboxylic acid 4-methyl ester; DTXSID40198298; RefChem:486957; DTXCID70120789; 829-776-6; 4-methoxycarbonyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid; MFCD01191977; HMS1766M15; AKOS001057884; SB62992; SY133052; CS-0221218; ST50893980; EN300-08614
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
1H-吡咯-2,4-二甲酸,3,5-二甲基-,4-甲酯(9Cl) · CAS 50296-60-1 · C9H11NO4. UNII HMS1766M15.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.