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175203-08-4

175203-08-4 structural image
Product Name: 4-(4-CHLOROPHENYL)PYRIMIDINE-2-THIOL
Formula: C10H7ClN2S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 26.7 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 222.69 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 222.0018471 g/mol
Monoisotopic Mass 222.0018471 g/mol
Topological Polar Surface Area 56.5 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 291
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