2-bromo-N-(2-chloro-5-cyano-3-nitrophenyl)acetamide
Basic information
- Standard SMILES
N#Cc1cc(NC(=O)CBr)c(Cl)c([N+](=O)[O-])c1- InChIKey
QNDWYEPWRYYTKW-UHFFFAOYSA-N- Molecular formula
- C9H5BrClN3O3
- Average molar mass
- 318.51 g/mol
Names & identifiers
- Preferred name
- 2-bromo-N-(2-chloro-5-cyano-3-nitrophenyl)acetamide
- IUPAC
- 2-bromo-N-(2-chloro-5-cyano-3-nitrophenyl)acetamide
Names & synonyms
2-bromo-N-(2-chloro-5-cyano-3-nitrophenyl)acetamideSCHEMBL15413605QNDWYEPWRYYTKW-UHFFFAOYSA-NDB-2115711541256-92-1
Database identifiers
- PubChem CID
- 89922341
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 364
Related reactions
3 records
Compound notes
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