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111950-69-7

111950-69-7 structural image
Product Name: 2-PHENOXYNICOTINAMIDE
Formula: C12H10N2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 28.8 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 214.22 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 214.074227566 g/mol
Monoisotopic Mass 214.074227566 g/mol
Topological Polar Surface Area 65.2 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 239
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