| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 20 | Yes |
Popular Name: tert-Butyl 4-cyano-4-pyrrolidin-1-ylpiperidine-1-carboxylate tert-Butyl 4-cyano-4-pyrrolidin-…
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CAS Numbers: 1119452-74-2 , [1119452-74-2]
BUTYLCYANOPYRROLIDINYLPIPERIDINECARBOXYLAT
tert-Butyl 4-cyano-4-(pyrrolidin-1-yl)piperidine-1-carboxylate
| 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) | 2.06 | 4.75 | -7.27 | 0 | 5 | 0 | 57 | 279.384 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 7.1 | -45.31 | 1 | 5 | 1 | 58 | 280.392 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
