Ethyl 4,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4,5-dimethyl-1H-pyrrole-2-carboxylate
Also Known As: Ethyl 4,5-dimethyl-1H-pyrrole-2-carboxylate|4,5-Dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester|2-Carbethoxy-4,5-dimethylpyrrole|2,3-dimethyl-5-carbethoxy-pyrrole|4077AJ|CE-190|1H-Pyrrole-2-carboxylic acid, 4,5-dimethyl-, ethyl ester|Ethyl 2,3-dimethyl-5-pyrrolecarboxylate|ethyl-4,5-dimethyl-2-pyrrole carboxylate|Ethyl4,5-dimethyl-1H-pyrrole-2-carboxylate|4,5-Dimethyl-pyrrol-2-carbonsaeure-aethylester|Ethyl 4,5-dimethyl-1H-pyrrole-2-carboxylate #|I11-0420|1H-Pyrrole-2-carboxylicacid, 4,5-dimethyl-, ethyl ester|873-231-5
| Molecular Formula | C9H13NO2 |
|---|---|
| Molecular Weight | 167.09464 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.09464 |
| Monoisotopic Mass | 167.09464 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 2199-45-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(N1)C)C |
| InChIKey | NJUXFNQDUIJYPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4,5-dimethyl-1H-pyrrole-2-carboxylate (CAS 2199-45-3), with molecular formula C9H13NO2 and molecular weight 167.09464 g/mol. IUPAC: ethyl 4,5-dimethyl-1H-pyrrole-2-carboxylate.