ethyl 3,5-dimethyl-4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | 8007-4147 |
| Compound Name: | ethyl 3,5-dimethyl-4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 237.3 |
| Molecular Formula: | C13 H19 N O3 |
| Smiles: | CCOC(c1c(C)c(C(C(C)C)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6725 |
| logD: | 2.6725 |
| logSw: | -2.6308 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.712 |
| InChI Key: | GZDDIMUUXLJHOS-UHFFFAOYSA-N |