2-[(Phenylthio)methyl]benzoic acid
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![2-[(Phenylthio)methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7c9c2df86c6942dc9965c93d8f6b490e.png "2-[(Phenylthio)methyl]benzoic acid")
2-[(Phenylthio)methyl]benzoic acid
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CAS No:
1699-03-2
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Formula:
C14H12O2S
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Chemical Name:
2-[(Phenylthio)methyl]benzoic acid
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Synonyms:
Benzoic acid,2-[(phenylthio)methyl]-;o-Toluic acid,α-(phenylthio)-;2-[(Phenylthio)methyl]benzoic acid;2-(Phenylthiomethyl)benzoic acid;α-(Phenylthio)-o-toluic acid;2-[(Phenylsulfanyl)methyl]benzoic acid
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CAS No:
Computed Properties
Molecular Weight:244.31
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:244.05580079
Monoisotopic Mass:244.05580079
Topological Polar Surface Area:62.6
Heavy Atom Count:17
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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