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477953-17-6

477953-17-6 structural image
Product Name: Quinoline, 8-ethyl-7-isothiocyanato- (9CI)
Formula: C12H10N2S
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COMPUTED DESCRIPTORS

Molecular Weight 214.29 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 214.05646950 g/mol
Monoisotopic Mass 214.05646950 g/mol
Topological Polar Surface Area 57.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 260
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