Basic information
- Standard SMILES
CC(=O)n1cc2ccccc2n1- InChIKey
YPSMXSXOHKSUNM-UHFFFAOYSA-N- Molecular formula
- C9H8N2O
- Average molar mass
- 160.17 g/mol
Names & identifiers
- Preferred name
- 1-(2H-Indazol-2-yl)ethanone
- IUPAC
- 1-indazol-2-ylethanone
Names & synonyms
1-(2H-Indazol-2-yl)ethanone13436-50-51-(2H-indazol-2-yl)ethan-1-one1-indazol-2-ylethanone2-Acetyl-2H-indazole2-Acetylindazole2H-Indazole, 2-acetyl- (6CI,7CI,8CI,9CI)2H-Indazole, 2-acetyl-SCHEMBL6337523YPSMXSXOHKSUNM-UHFFFAOYSA-NDB-281821InChI=1/C9H8N2O/c1-7(12)11-6-8-4-2-3-5-9(8)10-11/h2-6H,1H
Database identifiers
- PubChem CID
- 15939275
- Nikkaji
- J2.787.950K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 193
Related reactions
3 records
Linked notes
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