ethyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 0080-0043 |
| Compound Name: | ethyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 209.24 |
| Molecular Formula: | C11 H15 N O3 |
| Smiles: | CCOC(c1c(C)c(C(C)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6754 |
| logD: | 1.6754 |
| logSw: | -1.4342 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.8 |
| InChI Key: | ZCNAULQFSXEJTD-UHFFFAOYSA-N |