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499771-04-9

499771-04-9 structural image
Product Name: 1-(2,1,3-BENZOTHIADIAZOL-4-YL)-2-BROMO-1-ETHANONE,97%
Formula: C8H5BrN2OS
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COMPUTED DESCRIPTORS

Molecular Weight 257.11 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 255.93060 g/mol
Monoisotopic Mass 255.93060 g/mol
Topological Polar Surface Area 71.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 214
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