| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 16 | Yes |
Popular Name: 4-tert-Butyl-3,5-dimethyl-1H-pyrrole-2-carboxylicacid ethyl ester 4-tert-Butyl-3,5-dimethyl-1H-pyr…
Find On: PubMed — Wikipedia — Google
CAS Number: 28991-95-9
4-tert-Butyl-3,5-dimethyl-1H-pyrrole-2-carboxylic
4-TERT-BUTYL-3,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER
| 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) | 3.53 | 6.87 | -6.54 | 1 | 3 | 0 | 42 | 223.316 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 99% | Fluorochem |
