Basic information
- CAS
411219-94-8- Standard SMILES
CC(=O)N1C=CC=CC2C=CC21- InChIKey
NAKGXIXECADKOJ-UHFFFAOYSA-N- Molecular formula
- C10H11NO
- Average molar mass
- 161.2 g/mol
Names & identifiers
- Preferred name
- 1-(2-Azabicyclo[5.2.0]nona-3,5,8-trien-2-yl)ethanone
- IUPAC
- 1-(2-azabicyclo[5.2.0]nona-3,5,8-trien-2-yl)ethanone
- English name
- 2-Azabicyclo[5.2.0]nona-3,5,8-triene, 2-acetyl- (9CI)
- Molecular formula
- C10H11NO
- Molecular weight
- 161.20044
Names & synonyms
2-Azabicyclo[5.2.0]nona-3,5,8-triene, 2-acetyl- (9CI)
Database identifiers
- CAS
411219-94-8
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 288
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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