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56709-74-1

56709-74-1 structural image
Product Name: 3-BROMO-5-METHOXY-2,6-DINITRO-BENZOIC ACID METHYL ESTER
Formula: C9H7BrN2O7
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COMPUTED DESCRIPTORS

Molecular Weight 335.06 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 333.94366 g/mol
Monoisotopic Mass 333.94366 g/mol
Topological Polar Surface Area 127 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 380
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