[3,5-dibromo-1-(cyanomethyl)-4-oxocyclohexa-2,5-dien-1-yl] acetate
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[3,5-dibromo-1-(cyanomethyl)-4-oxocyclohexa-2,5-dien-1-yl] acetate
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CAS No:
84713-43-9
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Formula:
C10H7Br2NO3
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Chemical Name:
[3,5-dibromo-1-(cyanomethyl)-4-oxocyclohexa-2,5-dien-1-yl] acetate
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Synonyms:
3,5-dibromo-1-acetoxy-4-oxo-2,5-cyclohexadiene-1-acetonitrile;dienone A;Dienone A;84713-43-9;DTXSID20233737;3,5-Dibromo-1-acetoxy-4-oxo-2,5-cyclohexadiene-1-acetonitrile;[3,5-dibromo-1-(cyanomethyl)-4-oxocyclohexa-2,5-dien-1-yl] acetate;2,5-Cyclohexadiene-1-acetonitrile, 1-(acetyloxy)-3,5-dibromo-4-oxo-
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CAS No:
[3,5-dibromo-1-(cyanomethyl)-4-oxocyclohexa-2,5-dien-1-yl] acetate Basic Attributes
348.97 g/mol
348.87722 g/mol
DTXSID20233737
Computed Properties
Molecular Weight:348.97
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:348.87722
Monoisotopic Mass:346.87927
Topological Polar Surface Area:67.2
Heavy Atom Count:16
Complexity:434
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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