Basic information
- Standard SMILES
O=[N+]([O-])c1cc(F)cc(-n2cnnc2)c1- InChIKey
ODXXUCDTAZIDDN-UHFFFAOYSA-N- Molecular formula
- C8H5FN4O2
- Average molar mass
- 208.15 g/mol
Names & identifiers
- Preferred name
- 4-(3-fluoro-5-nitrophenyl)-4H-1,2,4-triazole
- IUPAC
- 4-(3-fluoro-5-nitrophenyl)-1,2,4-triazole
Names & synonyms
SCHEMBL2358696ODXXUCDTAZIDDN-UHFFFAOYSA-N4-(3-fluoro-5-nitrophenyl)-4H-1,2,4-triazole
Database identifiers
- PubChem CID
- 67377342
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Related reactions
2 records
Compound notes
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