diethyl 5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate
diethyl 5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 1161-0071 |
| Compound Name: | diethyl 5-formyl-3-methyl-1H-pyrrole-2,4-dicarboxylate |
| Molecular Weight: | 253.25 |
| Molecular Formula: | C12 H15 N O5 |
| Smiles: | [H]C(c1c(C(=O)OCC)c(C)c(C(=O)OCC)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5444 |
| logD: | 1.5443 |
| logSw: | -1.4637 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.575 |
| InChI Key: | WPKKEQCPXUTCDZ-UHFFFAOYSA-N |