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63185-86-4

63185-86-4 structural image
Product Name: 5-AMINO-2-(PHENYLTHIO)BENZOIC ACID
Formula: C13H11NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 245.30 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 245.05104977 g/mol
Monoisotopic Mass 245.05104977 g/mol
Topological Polar Surface Area 88.6 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 266
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