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107856-31-5

107856-31-5 structural image
Product Name: 5-Amino-1-(2-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
Formula: C11H9ClN4
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COMPUTED DESCRIPTORS

Molecular Weight 232.67 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 232.0515740 g/mol
Monoisotopic Mass 232.0515740 g/mol
Topological Polar Surface Area 67.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 300
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