Basic information
- CAS
63460-09-3- Standard SMILES
Nc1cc([N+](=O)[O-])cc(Br)c1[N+](=O)[O-]- InChIKey
MPBKJZTVFZSAAK-UHFFFAOYSA-N- Molecular formula
- C6H4BrN3O4
- Average molar mass
- 262.02 g/mol
- Monoisotopic mass
- 260.93852
Names & identifiers
- Preferred name
- AR-Bromo-AR,AR-dinitrobenzenamine
- IUPAC
- 3-bromo-2,5-dinitroaniline
Names & synonyms
AR-BROMO-AR,AR-DINITROBENZENAMINE63460-09-33-bromo-2,5-dinitroanilineDTXSID00212883
Database identifiers
- CAS
63460-09-3- PubChem CID
- 44536
- DTXSID
DTXSID00212883
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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