| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 18 | Yes |
Popular Name: 3-Oxo-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-ethyl ester 3-Oxo-pyrrolidine-1,2-dicarboxyl…
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CAS Numbers: 170123-25-8 , [170123-25-8]
1-tert-butyl 2-ethyl 3-oxopyrrolidine-1,2-dicarboxylate
3-Oxo-pyrrolidine-1,2-dicarboxylic acid1-tert-butyl ester 2-ethyl ester
Ethyl N-Boc-3-oxopyrrolidine-2-carboxylate
EthylN-Boc-3-oxopyrrolidine-2-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) | 0.90 | 5.93 | -12.99 | 0 | 6 | 0 | 73 | 257.286 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 5.95 | -49.12 | 0 | 6 | -1 | 79 | 256.278 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
