Basic information
- Standard SMILES
O=[N+]([O-])c1nccn1Cc1ccccc1- InChIKey
NJKSHSRYEUUIFB-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2
- Average molar mass
- 203.2 g/mol
Names & identifiers
- Preferred name
- 1-benzyl-2-nitro-1H-imidazole
- IUPAC
- 1-benzyl-2-nitroimidazole
Names & synonyms
1-benzyl-2-nitro-1H-imidazole501650-56-2NSC321260N-benzyl-2-nitroimidazoleSCHEMBL1126153SCHEMBL27442483NJKSHSRYEUUIFB-UHFFFAOYSA-NNSC-321260DB-337065
Database identifiers
- PubChem CID
- 331120
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 223
Related reactions
15 records
Compound notes
Loading…