1,7-Diazabicyclo[4.2.0]octan-8-one
Completing data — refresh the page later to see the latest
Basic information
- CAS
139424-12-7- Standard SMILES
O=C1NC2CCCCN12- InChIKey
DTMFTCKPWKZSGN-UHFFFAOYSA-N- Molecular formula
- C6H10N2O
- Average molar mass
- 126.16 g/mol
- Monoisotopic mass
- 126.07931295
Names & identifiers
- Preferred name
- 1,7-Diazabicyclo[4.2.0]octan-8-one
- IUPAC
- 1,7-diazabicyclo[4.2.0]octan-8-one
- English name
- 1,7-Diazabicyclo[4.2.0]octan-8-one(9CI)
- Molecular formula
- C6H10N2O
- Molecular weight
- 0
Names & synonyms
139424-12-71,7-DIAZABICYCLO[4.2.0]OCTAN-8-ONESCHEMBL2366282DTXSID606660601,7-Diazabicyclo[4.2.0]octan-8-one(9CI)
Database identifiers
- CAS
139424-12-7- PubChem CID
- 45087293
- DTXSID
DTXSID60666060
Properties
Computed structural propertiesFilling in
- XLogP
- 0.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 146
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…