methyl 4-[(4-chlorophenoxy)acetyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(4-chlorophenoxy)acetyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[(4-chlorophenoxy)acetyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V028-8433 |
| Compound Name: | methyl 4-[(4-chlorophenoxy)acetyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 335.79 |
| Molecular Formula: | C17 H18 Cl N O4 |
| Smiles: | Cc1c(C(COc2ccc(cc2)[Cl])=O)c(C)n(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2311 |
| logD: | 3.2311 |
| logSw: | -4.0036 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.695 |
| InChI Key: | CAKGNVYOLMMTPA-UHFFFAOYSA-N |