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104688-01-9

104688-01-9 structural image
Product Name: ethyl 2-bromo-2-(thiophen-2-yl)acetate
Formula: C8H9BrO2S
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COMPUTED DESCRIPTORS

Molecular Weight 249.13 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 247.95066 g/mol
Monoisotopic Mass 247.95066 g/mol
Topological Polar Surface Area 54.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 163
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes