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71683-01-7

71683-01-7 structural image
Product Name: 3-(5-CHLORO-THIOPHEN-2-YL)-3-OXO-PROPIONITRILE
Formula: C7H4ClNOS
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COMPUTED DESCRIPTORS

Molecular Weight 185.63 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 184.9702126 g/mol
Monoisotopic Mass 184.9702126 g/mol
Topological Polar Surface Area 69.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 210
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