In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 16 | Yes |
Popular Name: tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-2(3H)-carboxylate tert-Butyl hexahydro-1H-pyrrolo[…
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CAS Numbers: 1220039-69-9 , 236406-56-7 , 885270-57-5 , [885270-57-5]
2H-PYRROLO[3,4-C]PYRIDINE-2-CARBOXYLIC ACID, OCTAHYDRO-, 1,1-DIMETHYLETHYL ESTER, (3AR,7AR)-REL-
octahydro-pyrrolo[3,4-c]pyridine-2-carboxylicacidtert-butylester
Octahydropyrrolo[3,4-c]pyridine-2-carboxylic acid tert-butyl ester
tert-Butyl hexahydro-1H-pyrrolo[3,4-c]pyridine-2(3H)-carboxylate hydrochloride
tert-butyl octahydro-1H-pyrrolo[3,4-c]pyridine-2-carboxylate
tert-butyl octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate
TERT-BUTYLHEXAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-2 -CARBOXYLATE
tert-Butylhexahydro-1H-pyrrolo[3,4-c]pyridine-2(3H)-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) | 1.55 | 4.92 | -44.65 | 2 | 4 | 1 | 46 | 227.328 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | US6140333 | IBM Patent Data |