1-Bromo-2,4-dimethyl-3,5-dinitrobenzene
Basic information
- CAS
6967-81-3- Standard SMILES
Cc1c(Br)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-]- InChIKey
IAXDCFGUXQRIBP-UHFFFAOYSA-N- Molecular formula
- C8H7BrN2O4
- Average molar mass
- 275.06 g/mol
- Monoisotopic mass
- 273.95892
Names & identifiers
- Preferred name
- 1-Bromo-2,4-dimethyl-3,5-dinitrobenzene
- IUPAC
- 1-bromo-2,4-dimethyl-3,5-dinitrobenzene
- English name
- 1-bromo-2,4-dimethyl-3,5-dinitro-benzene
- Molecular formula
- C8H7BrN2O4
- Molecular weight
- 0
Names & synonyms
6967-81-31-bromo-2,4-dimethyl-3,5-dinitrobenzeneNSC20685DTXSID30281183NSC-206851-bromo-2,4-dimethyl-3,5-dinitro-benzene
Database identifiers
- CAS
6967-81-3- PubChem CID
- 228079
- DTXSID
DTXSID30281183
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 275
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Related reactions
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Compound notes
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