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54002-30-1

54002-30-1 structural image
Product Name: 3,5-BIS(ACETYLAMINO)-4-METHYL-2-NITRO-BENZOIC ACID
Formula: C12H13N3O6
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COMPUTED DESCRIPTORS

Molecular Weight 295.25 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 295.08043514 g/mol
Monoisotopic Mass 295.08043514 g/mol
Topological Polar Surface Area 141 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 460
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes