Basic information
- CAS
692283-75-3- Standard SMILES
Cc1cc(Br)c(NC(=O)c2cccc([N+](=O)[O-])c2)cc1C- InChIKey
BGWHYPGXXIUDJG-UHFFFAOYSA-N- Molecular formula
- C15H13BrN2O3
- Average molar mass
- 349.18 g/mol
- Monoisotopic mass
- 348.01095
Names & identifiers
- Preferred name
- N-(2-bromo-4,5-dimethylphenyl)-3-nitrobenzamide
- IUPAC
- N-(2-bromo-4,5-dimethylphenyl)-3-nitrobenzamide
Names & synonyms
N-(2-bromo-4,5-dimethylphenyl)-3-nitrobenzamide692283-75-3DTXSID301244193STL358588AKOS000436821
Database identifiers
- CAS
692283-75-3- PubChem CID
- 891127
- DTXSID
DTXSID301244193
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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