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915395-41-4

915395-41-4 structural image
Product Name: 3-chloroisothiazole-4-carbonitrile
Formula: C4HClN2S
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COMPUTED DESCRIPTORS

Molecular Weight 144.58 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 143.9548969 g/mol
Monoisotopic Mass 143.9548969 g/mol
Topological Polar Surface Area 64.9 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 129
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