3-Phenyl-1-azabicyclo[1.1.0]butane
Basic information
- CAS
17945-94-7- Standard SMILES
c1ccc(C23CN2C3)cc1- InChIKey
HYSAJZJNEJKIMJ-UHFFFAOYSA-N- Molecular formula
- C9H9N
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.07349929
Names & identifiers
- Preferred name
- 3-Phenyl-1-azabicyclo[1.1.0]butane
- IUPAC
- 3-phenyl-1-azabicyclo[1.1.0]butane
Names & synonyms
3-phenyl-1-azabicyclo[1.1.0]butane17945-94-73-Phenyl-1-aza-bicyclo[1.1.0]butane1-Azabicyclo[1.1.0]butane, 3-phenyl-DTXSID00340933HYSAJZJNEJKIMJ-UHFFFAOYSA-N
Database identifiers
- CAS
17945-94-7- PubChem CID
- 568613
- DTXSID
DTXSID00340933- Nikkaji
- J1.044.331H
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 152
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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