| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 19 | Yes |
Popular Name: 3,5-Dimethyl-1H-pyrrole-2,4-dicarboxylic acid 4-tert-butyl ester 2-ethyl ester 3,5-Dimethyl-1H-pyrrole-2,4-dica…
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CAS Number: 361380-77-0
1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-(1,1-dimethylethyl) 2-ethyl ester (9CI)
4-tert-Butyl 2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
4-tert-Butyl 2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate 98%
| 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) | 2.84 | 2.93 | -9.02 | 1 | 5 | 0 | 68 | 267.325 | 6 | ↓ |
