In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 18 | Yes |
Popular Name: (2S)-1-tert-Butyl 2-ethyl 4-hydroxypyrrolidine-1,2-dicarboxylate (2S)-1-tert-Butyl 2-ethyl 4-hydr…
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CAS Numbers: 200129-53-9 , 37813-30-2 , [200129-53-9]
(2S)-1-tert-Butyl2-ethyl4-hydroxypyrrolidine-1,2-dicarboxylate
(2S,4R)-1-tert-Butyl2-ethyl4-hydroxypyrrolidine-1,2-dicarboxylate
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) | 1.09 | 3.21 | -12.72 | 1 | 6 | 0 | 76 | 259.302 | 5 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO2000001714A1 | IBM Patent Data |