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3111-54-4

3111-54-4 structural image
Product Name: 2-Phenylthiopyridine
Formula: C11H9NS
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >28.1 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 187.26 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 187.04557046 g/mol
Monoisotopic Mass 187.04557046 g/mol
Topological Polar Surface Area 38.2 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 143
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