Basic information
- Standard SMILES
Fc1ccc(Br)c(-n2ccnn2)c1- InChIKey
DHUOUCZMKREPGE-UHFFFAOYSA-N- Molecular formula
- C8H5BrFN3
- Average molar mass
- 242.05 g/mol
Names & identifiers
- Preferred name
- 1-(2-Bromo-5-fluorophenyl)-1H-1,2,3-triazole
- IUPAC
- 1-(2-bromo-5-fluorophenyl)triazole
Names & synonyms
SCHEMBL2524013DHUOUCZMKREPGE-UHFFFAOYSA-N1-(2-Bromo-5-fluorophenyl)-1H-1,2,3-triazole
Database identifiers
- PubChem CID
- 21069764
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 181
Related reactions
12 records
Compound notes
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