Structure Info
- Chemspace ID
- CSSS00010477677 (In-Stock Screening Compounds)
- CAS
- 1392803-98-3, 1253654-74-8
- MFCD
- MFCD23106183
- IUPAC Name
- 2-[(tert-butoxy)carbonyl]-2-azabicyclo[3.1.1]heptane-1-carboxylic acid
- Mol formula
- C12H19NO4
- Mol weight
- 241 Da
- Catalog Number(s)
- A490028167, AA00HVFH, AG00HVI9, AG162987, AGNPC-0WCKZY, AI33785, AQ33785, AR00HW79, AS-79363, BB4LS-EN300-6939019, BBV-45284054, BD315074, CD11266536, CM321190, CSC010477677, D655938, EN300-6939019, F503812, FCH1845647, LN02188500, P13668, P13668-0.1G, P13668-0.5G, P43875, PBN20121791, SFC80398, SY270271, Z1509117427, ZXC088622
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.52
- Heavy atoms count
- 17
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00010477677
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