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25562-83-8

25562-83-8 structural image
Product Name: 2-[(PHENYLSULFINYL)METHYL]BENZOIC ACID
Formula: C14H12O3S
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COMPUTED DESCRIPTORS

Molecular Weight 260.31 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 260.05071541 g/mol
Monoisotopic Mass 260.05071541 g/mol
Topological Polar Surface Area 73.6 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 310
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes