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7597-68-4

7597-68-4 structural image
Product Name: Ethyl 2-(1-benzothiophen-3-yl)acetate
Formula: C12H12O2S
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COMPUTED DESCRIPTORS

Molecular Weight 220.29 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 220.05580079 g/mol
Monoisotopic Mass 220.05580079 g/mol
Topological Polar Surface Area 54.5 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 230
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