Basic information
- Standard SMILES
O=C1CCc2cc(-n3nccn3)ccc21- InChIKey
COASYKXWMPEJSM-UHFFFAOYSA-N- Molecular formula
- C11H9N3O
- Average molar mass
- 199.21 g/mol
- Monoisotopic mass
- 199.07456192
Names & identifiers
- Preferred name
- 5-(2H-1,2,3-Triazol-2-yl)indan-1-one
- IUPAC
- 5-(triazol-2-yl)-2,3-dihydroinden-1-one
Names & synonyms
5-(2H-1,2,3-Triazol-2-yl)indan-1-one1334784-80-35-(triazol-2-yl)-2,3-dihydroinden-1-oneSCHEMBL2437598COASYKXWMPEJSM-UHFFFAOYSA-NDB-103922A1-031265-(2H-1,2,3-Triazol-2-yl)-2,3-dihydro-1H-inden-1-one
Database identifiers
- PubChem CID
- 58438478
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 47.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 263
Related reactions
4 records
Compound notes
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