| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: methyl 4-acetyl-1-methyl-1H-pyrrole-2-carboxylate methyl 4-acetyl-1-methyl-1H-pyrr…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 85795-19-3 , [85795-19-3]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.82 | 5.08 | -8.98 | 0 | 4 | 0 | 48 | 181.191 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 91 - 93 | KeyOrganics |
| MP | 91-93° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
