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2082-67-9

2082-67-9 structural image
Product Name: 3,4-DICHLOROBENZYL THIOCYANATE
Formula: C8H5Cl2NS
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COMPUTED DESCRIPTORS

Molecular Weight 218.10 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 216.9519757 g/mol
Monoisotopic Mass 216.9519757 g/mol
Topological Polar Surface Area 49.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 189
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