α-Methyl[1,1′-biphenyl]-4-acetic acid
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![α-Methyl[1,1′-biphenyl]-4-acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0c0c991f9d754cd497567c5d32a7a89d.png "α-Methyl[1,1′-biphenyl]-4-acetic acid")
α-Methyl[1,1′-biphenyl]-4-acetic acid
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CAS No:
6341-72-6
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Formula:
C15H14O2
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Chemical Name:
α-Methyl[1,1′-biphenyl]-4-acetic acid
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Synonyms:
[1,1′-Biphenyl]-4-acetic acid,α-methyl-;4-Biphenylacetic acid,α-methyl-;Hydratropic acid,p-phenyl-;α-Methyl[1,1′-biphenyl]-4-acetic acid;2-(4-Biphenylyl)propionic acid;2-(4-Biphenyl)propionic acid;(±)-2-(4-Biphenyl)propionic acid;Biprofen;NSC 16300;2-(4-Phenylphenyl)propionic acid;16300Y1;2-((1,1′-Biphenyl]-4-yl)propanoic acid;2-(4-Biphenylyl)propanoic acid;2-(4-Phenylphenyl)propanoic acid;92937-21-8
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CAS No:
α-Methyl[1,1′-biphenyl]-4-acetic acid Use and Manufacturing
A metabolite ofIsopropylbiphenyl, a COX-2 selective inhibitor. Also an impurity of Flurbiprofen (F598700).
Computed Properties
Molecular Weight:226.27
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:226.099379685
Monoisotopic Mass:226.099379685
Topological Polar Surface Area:37.3
Heavy Atom Count:17
Complexity:248
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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α-Methyl[1,1′-biphenyl]-4-acetic acid
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