3-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid
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![3-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/39f8bfa6270348308ce53f4247f7ceee.png "3-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid")
3-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid
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CAS No:
915880-65-8
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Formula:
C15H11NO3S
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Chemical Name:
3-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid
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Synonyms:
3-[(1,3-benzoxazol-2-ylthio)methyl]benzoic acid;915880-65-8;3-(benzooxazol-2-ylsulfanylmethyl)benzoic Acid;3-[(1,3-benzoxazol-2-ylsulfanyl)methyl]benzoic acid;CTK7I8656;HMS1605I14;ALBB-004054;ZINC6697140;SBB046516;STK501038
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CAS No:
Computed Properties
Molecular Weight:285.3
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:285.04596439
Monoisotopic Mass:285.04596439
Topological Polar Surface Area:88.6
Heavy Atom Count:20
Complexity:352
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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