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21727-09-3

21727-09-3 structural image
Product Name: Pentachloromandelonitrile
Formula: C8H2Cl5NO
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COMPUTED DESCRIPTORS

Molecular Weight 305.4 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 304.854952 g/mol
Monoisotopic Mass 302.857902 g/mol
Topological Polar Surface Area 44 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 264
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes