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1071166-49-8

1071166-49-8 structural image
Product Name: 4-(6-CHLORO-2-FLUOROPHENYL)-1H-1,2,3-TRIAZOLE-5-CARBONITRILE
Formula: C9H4ClFN4
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COMPUTED DESCRIPTORS

Molecular Weight 222.60 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 222.0108520 g/mol
Monoisotopic Mass 222.0108520 g/mol
Topological Polar Surface Area 65.4 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 279
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