4-[2-CHLORO-4-(METHYLTHIO)PHENYL]-4-OXOBUTYRIC ACID
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![4-[2-CHLORO-4-(METHYLTHIO)PHENYL]-4-OXOBUTYRIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0622f446ccbd46198b5820ce6ceb726d.png "4-[2-CHLORO-4-(METHYLTHIO)PHENYL]-4-OXOBUTYRIC ACID")
4-[2-CHLORO-4-(METHYLTHIO)PHENYL]-4-OXOBUTYRIC ACID
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CAS No:
103860-95-3
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Formula:
C11H11ClO3S
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Chemical Name:
4-[2-CHLORO-4-(METHYLTHIO)PHENYL]-4-OXOBUTYRIC ACID
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Synonyms:
4-[2-Chloro-4-(methylthio)phenyl]-4-oxobutyric acid;CTK4A2452;DTXSID90645484;ZINC43214172;AKOS016022770;4-[2-Chloro-4-(methylsulfanyl)phenyl]-4-oxobutanoic acid
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CAS No:
Computed Properties
Molecular Weight:258.72
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:258.0117431
Monoisotopic Mass:258.0117431
Topological Polar Surface Area:79.7
Heavy Atom Count:16
Complexity:270
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-[2-CHLORO-4-(METHYLTHIO)PHENYL]-4-OXOBUTYRIC ACID
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