Basic information
- CAS
23806-36-2- Standard SMILES
O=C1CC2CCCN12- InChIKey
INAHHIFQCVEWPW-UHFFFAOYSA-N- Molecular formula
- C6H9NO
- Average molar mass
- 111.14 g/mol
- Monoisotopic mass
- 111.06841391
Names & identifiers
- Preferred name
- 1-Azabicyclo(3.2.0)heptan-7-one
- IUPAC
- 1-azabicyclo[3.2.0]heptan-7-one
- English name
- 1-Azabicyclo[3.2.0]heptan-7-one
- Molecular formula
- C6H9NO
- Molecular weight
- 111.14
Names & synonyms
1-Azabicyclo[3.2.0]heptan-7-one23806-36-2DTXSID103384871-Azabicyclo(3.2.0)heptan-7-oneRefChem:227632DTXCID20289572Carbapenam(5S)-1-Azabicyclo[3.2.0]heptan-7-oneTetrahydropyrrolo[1,2-a]azetidin-2-one3S6CW82TW8SCHEMBL2762585INAHHIFQCVEWPW-UHFFFAOYSA-N
Show more names
1-Azabicyclo[3.2.0]heptan-7-on1-Azabicyclo[3.2.0]heptan-7-one #Q5037836
Database identifiers
- CAS
23806-36-2- PubChem CID
- 549337
- DTXSID
DTXSID10338487- UNII
- 3S6CW82TW8
- Nikkaji
- J88.202J
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- FDA UNII
- 3 S6CW82TW8 · 3S6CW82TW8
Related reactions
3 records
Compound notes
Loading…