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153754-31-5

153754-31-5 structural image
Product Name: METHYL 2-BROMOMETHYL-3,5-DINITRO-BENZOATE
Formula: C9H7BrN2O6
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COMPUTED DESCRIPTORS

Molecular Weight 319.07 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 317.94875 g/mol
Monoisotopic Mass 317.94875 g/mol
Topological Polar Surface Area 118 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 352
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