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90945-94-1

90945-94-1 structural image
Product Name: 2-METHYL-QUINOLINE-4-THIOL
Formula: C10H9NS
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Solubility 20.5 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 175.25 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 175.04557046 g/mol
Monoisotopic Mass 175.04557046 g/mol
Topological Polar Surface Area 44.1 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 232
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