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81569-51-9

81569-51-9 structural image
Product Name: 5-Thiazolecarboxylicacid,2-bromo-4-methyl-,methylester(9CI)
Formula: C6H6BrNO2S
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COMPUTED DESCRIPTORS

Molecular Weight 236.09 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 234.93026 g/mol
Monoisotopic Mass 234.93026 g/mol
Topological Polar Surface Area 67.4 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 167
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