2-(benzenesulfinyl)benzoic acid
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2-(benzenesulfinyl)benzoic acid
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CAS No:
32664-47-4
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Formula:
C13H10O3S
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Chemical Name:
2-(benzenesulfinyl)benzoic acid
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Synonyms:
2-(Phenylsulfinyl)benzoic acid;32664-47-4;NSC 289492;BRN 2110898;BENZOIC ACID, o-(PHENYLSULFINYL)-;0-10-00-00127 (Beilstein Handbook Reference);SCHEMBL506130;o-(Phenylsulfinyl)benzoic acid;CHEMBL3277070;NSC289492;NSC-289492;Benzoic acid, 2-(phenylsulfinyl)- (9CI)
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CAS No:
Computed Properties
Molecular Weight:246.28
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:246.03506535
Monoisotopic Mass:246.03506535
Topological Polar Surface Area:73.6
Heavy Atom Count:17
Complexity:297
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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