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21617-11-8

21617-11-8 structural image
Product Name: 8-CHLORO-2,3-DIHYDROQUINOLIN-4(1H)-ONE
Formula: C9H8ClNO
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 20.9 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 181.62 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 181.0294416 g/mol
Monoisotopic Mass 181.0294416 g/mol
Topological Polar Surface Area 29.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 195
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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