4-Bromo-1,2-dinitrobenzene
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4-Bromo-1,2-dinitrobenzene
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CAS No:
610-38-8
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Formula:
C6H3BrN2O4
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Chemical Name:
4-Bromo-1,2-dinitrobenzene
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Synonyms:
Benzene,4-bromo-1,2-dinitro-;4-Bromo-1,2-dinitrobenzene;3,4-Dinitrobromobenzene;NSC 10252
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CAS No:
4-Bromo-1,2-dinitrobenzene Use and Manufacturing
To a cold solution of trifluoroacetic acid (25 mL) at 0° C. was added compound 8 (4.96 g, 22.96 mmol). After being stirred for 10 minutes, a solution of 33percent hydrogen peroxide (13.75 mL, 133 mmol) was added, and the mixture was stirred at room temperature for 0.5 h, followed by stirring at 50° C. for 2 h. The mixture was poured into ice water, and the solid obtained was filtered and washed with cold water to get the titled compound 24. Yield: 76percent, yellow solid.
Computed Properties
Molecular Weight:247.00
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Exact Mass:245.92762
Monoisotopic Mass:245.92762
Topological Polar Surface Area:91.6
Heavy Atom Count:13
Complexity:224
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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