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175205-67-1

175205-67-1 structural image
Product Name: 2-CYANO-5-(ISOXASOL-3-YL)THIOPHENE
Formula: C8H4N2OS
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COMPUTED DESCRIPTORS

Molecular Weight 176.20 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 176.00443393 g/mol
Monoisotopic Mass 176.00443393 g/mol
Topological Polar Surface Area 78.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 212
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