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58142-53-3

58142-53-3 structural image
Product Name: ISOQUINOLINE, 3-CHLORO-5-FLUORO-
Formula: C9H5ClFN
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COMPUTED DESCRIPTORS

Molecular Weight 181.59 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 181.0094550 g/mol
Monoisotopic Mass 181.0094550 g/mol
Topological Polar Surface Area 12.9 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 165
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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