1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester (CAS 5463-44-5) — formula C9H12N2O4, molecular weight 212.20; category organic chemicals.
| CAS Number | 5463-44-5 |
|---|---|
| Molecular Formula | C9H12N2O4 |
| Molecular Weight | 212.20 |
| LogP | 1.9 |
| Category | Organic Chemicals |
1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester is a carbon-based organic compound with CAS registry number 5463-44-5 and molecular formula C9H12N2O4 (molecular weight 212.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5463-44-5
Its molecular formula C9H12N2O4 comprises 9 C, 12 H, 2 N, 4 O atoms.
Also known as: 1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester · 3,5-二甲基-4-硝基-1H-吡咯-2-甲酸乙酯
Category: organic chemicals
The CAS registry number of 1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester is 5463-44-5.
Molecular formula C9H12N2O4, molecular weight 212.20.
It is also registered under: 1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester, 3,5-二甲基-4-硝基-1H-吡咯-2-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for 1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester (CAS 5463-44-5), compiled from public chemistry databases.
| CAS 号 | 5463-44-5 |
|---|---|
| PubChem CID | 138518 |
| 分子式 | C9H12N2O4 |
| IUPAC 名称 | ethyl 3,5-dimethyl-4-nitro-1H-pyrrole-2-carboxylate |
| UNII（FDA） | ST50339624 |
| Molecular Weight | 212.20 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 212.07970687 |
| Monoisotopic Mass | 212.07970687 |
| Topological Polar Surface Area | 87.9 |
| Heavy Atom Count | 15 |
5463-44-5; 1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester; DTXSID30203062; NSC 13424; RefChem:240513; DTXCID30125553; Ethyl 3,5-dimethyl-4-nitro-1H-pyrrole-2-carboxylate; Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester; NSC13424; SCHEMBL3023400; 3,5-Dimethyl-4-nitro-1H-pyrrole-2-carboxylic acid ethyl ester; NSC-13424; AKOS000732379; SB62662; DB-165124; ST50339624
3,5-二甲基-4-硝基-1H-吡咯-2-甲酸乙酯 · CAS 5463-44-5 · C9H12N2O4. UNII ST50339624.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.