ethyl 4-butyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-butyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-butyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | 8015-7006 |
| Compound Name: | ethyl 4-butyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 223.31 |
| Molecular Formula: | C13 H21 N O2 |
| Smiles: | CCCCc1c(C)c(C(=O)OCC)[nH]c1C |
| Stereo: | ACHIRAL |
| logP: | 3.877 |
| logD: | 3.877 |
| logSw: | -3.7611 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.973 |
| InChI Key: | STNGULMWFPMOCE-UHFFFAOYSA-N |