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120450-07-9

120450-07-9 structural image
Product Name: 2-AMINO-4-(4-CHLOROPHENYL)-1H-PYRROLE-3-CARBONITRILE
Formula: C11H8ClN3
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COMPUTED DESCRIPTORS

Molecular Weight 217.65 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 217.0406750 g/mol
Monoisotopic Mass 217.0406750 g/mol
Topological Polar Surface Area 65.6 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 264
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

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