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99696-21-6

99696-21-6 structural image
Product Name: ethyl 8-chloro-1-cyclopropyl-6,7-difluoro-1,4-dihydroquinoline-4-oxo-3-carboxyla
Formula: C15H12ClF2NO3
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COMPUTED DESCRIPTORS

Molecular Weight 327.71 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 327.0473773 g/mol
Monoisotopic Mass 327.0473773 g/mol
Topological Polar Surface Area 46.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 523
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