Basic information
- Standard SMILES
CC(Nc1cc(F)ccc1[N+](=O)[O-])c1cccc(Br)c1- InChIKey
KKEFYTGADFFLHB-UHFFFAOYSA-N- Molecular formula
- C14H12BrFN2O2
- Average molar mass
- 339.16 g/mol
Names & identifiers
- Preferred name
- N-(1-(3-bromophenyl)ethyl)-5-fluoro-2-nitrobenzenamine
- IUPAC
- N-[1-(3-bromophenyl)ethyl]-5-fluoro-2-nitroaniline
Names & synonyms
SCHEMBL1748422KKEFYTGADFFLHB-UHFFFAOYSA-NAKOS012848186N-(1-(3-bromophenyl)ethyl)-5-fluoro-2-nitrobenzenamine
Database identifiers
- PubChem CID
- 58707271
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 340
Related reactions
6 records
Compound notes
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