1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID (CAS 13138-78-8) — formula C6H6N2O4, molecular weight 170.12; category organic chemicals.
| CAS Number | 13138-78-8 |
|---|---|
| Molecular Formula | C6H6N2O4 |
| Molecular Weight | 170.12 |
| LogP | 0.4 |
| Category | Organic Chemicals |
1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID is a carbon-based organic compound with CAS registry number 13138-78-8 and molecular formula C6H6N2O4 (molecular weight 170.12), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13138-78-8
Its molecular formula C6H6N2O4 comprises 6 C, 6 H, 2 N, 4 O atoms.
Also known as: 1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID · 1-甲基-4-硝基吡咯-2-羧酸
Category: organic chemicals
The CAS registry number of 1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID is 13138-78-8.
Molecular formula C6H6N2O4, molecular weight 170.12.
It is also registered under: 1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID, 1-甲基-4-硝基吡咯-2-羧酸.
Category: Organic Chemicals.
Independent reference data for 1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID (CAS 13138-78-8), compiled from public chemistry databases.
| CAS 号 | 13138-78-8 |
|---|---|
| PubChem CID | 2736915 |
| 分子式 | C6H6N2O4 |
| IUPAC 名称 | 1-methyl-4-nitropyrrole-2-carboxylic acid |
| UNII（FDA） | Z164707398 |
| Molecular Weight | 170.12 |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 170.03275668 |
| Monoisotopic Mass | 170.03275668 |
| Topological Polar Surface Area | 88.1 |
| Heavy Atom Count | 12 |
1-methyl-4-nitropyrrole-2-carboxylic acid; RefChem:434389; 635-106-1; 1-Methyl-4-nitro-1H-pyrrole-2-carboxylic acid; 13138-78-8; MFCD02180913; 1H-PYRROLE-2-CARBOXYLIC ACID, 1-METHYL-4-NITRO-; Maybridge1_008754; 1-methyl-4-nitro-pyrrole-2-carboxylic acid; Oprea1_817970; 1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLICACID; CHEMBL275510; SCHEMBL1662655; HMS566F20; DTXSID80371700; GEGNYFQOFWUIFG-UHFFFAOYSA-N
| 已通报的危害声明 | H302 (100%) |
|---|
1-甲基-4-硝基吡咯-2-羧酸 · CAS 13138-78-8 · C6H6N2O4. UNII Z164707398.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-甲基-4-硝基吡咯-2-羧酸