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1189880-12-3

1189880-12-3 structural image
Product Name: 2-(3-CHLOROPHENYL)-1-(3-PYRIDINYL-D4)-1-ETHANONE
Formula: C13H6ClD4NO
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COMPUTED DESCRIPTORS

Molecular Weight 235.70 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 235.0701986 g/mol
Monoisotopic Mass 235.0701986 g/mol
Topological Polar Surface Area 30 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 244
Isotope Atom Count 4
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