| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2009 | 23 | Yes |
Popular Name: tert-Butyl 7-benzyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate tert-Butyl 7-benzyl-3,7-diazabic…
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CAS Numbers: 227940-71-8 , 327940-71-8 , [227940-71-8]
(1R,5S)-3-Boc-7-benzyl-3,7-diazabicyclo[3.3.1]nonane
(1R,5S)-tert-Butyl 7-benzyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate
(1R,5S)-tert-Butyl7-benzyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate
7-BENZYL-3-BOC-3,7-DIAZABICYCLO[3.3.1]NONANE
BUTYLBENZYLDIAZABICYCLONONANECARBOXYLAT
tert-Butyl 7-benzyl-3,7-diaza-bicyclo[3.3.1]nonane-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) | 3.54 | 11.43 | -33.61 | 1 | 4 | 1 | 34 | 317.453 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 10.21 | -6.45 | 0 | 4 | 0 | 33 | 316.445 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 97% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
