Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(-n2nnnc2-c2ccccc2Br)cc1- InChIKey
CCNJJLWTHMYYQO-UHFFFAOYSA-N- Molecular formula
- C13H8BrN5O2
- Average molar mass
- 346.14 g/mol
Names & identifiers
- Preferred name
- 5-(2-bromophenyl)-1-(4-nitrophenyl)-1H-tetrazole
- IUPAC
- 5-(2-bromophenyl)-1-(4-nitrophenyl)tetrazole
Names & synonyms
SCHEMBL7283374CCNJJLWTHMYYQO-UHFFFAOYSA-N5-(2-bromophenyl)-1-(4-nitrophenyl)-1H-tetrazole
Database identifiers
- PubChem CID
- 19935790
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 372
Related reactions
15 records
Compound notes
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