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656226-63-0

656226-63-0 structural image
Product Name: 5-(1H-PYRAZOL-3-YL)-2-THIOPHENECARBOXYLIC ACID
Formula: C8H6N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 194.21 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 194.01499861 g/mol
Monoisotopic Mass 194.01499861 g/mol
Topological Polar Surface Area 94.2 Ų
Heavy Atom Count 13
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