| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2005 | 12 | Yes |
Popular Name: ethyl 1-methylpiperidine-3-carboxylate ethyl 1-methylpiperidine-3-carbo…
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CAS Numbers: 5166-67-6 , [5166-67-6]
1-Methylnipecotic acid ethyl ester
3-Piperidinecarboxylic acid, 1-methyl-, ethyl ester
Ethyl 1-methyl-3-piperidinecarboxylate
Ethyl 1-methylpiperidine-3-carboxylate 97%
Ethyl N-methylpiperidine-3-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) | 1.35 | 6.25 | -39.02 | 1 | 3 | 1 | 31 | 172.248 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 59 - 61 | Enamine Building Blocks |
| MP | 59...61 | Enamine Building Blocks |
| Boiling_Point | 88-89? | Alfa-Aesar |
| Boiling_Point | 88-89° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| BP | 96 / 12 | TCI |
No pre-computed analogs available. Try a structural similarity search.