Structure Info
- Chemspace ID
- CSMB00135478391 (Enamine MADE)
- CAS
- 2137095-96-4
- MFCD
- MFCD30734473
- IUPAC Name
- 3-tert-butyl 6-chloromethyl (1R,5S,6R)-6-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane-3,6-dicarboxylate
- Mol formula
- C13H17ClF3NO4
- Mol weight
- 344 Da
- Catalog Number(s)
- BBV-110004824, CSC135478391, EN300-386429, FCH9165811
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.22
- Heavy atoms count
- 22
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.846
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00135478391
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