2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid
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![2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f1a27ce8a0a74ba0b62d36843204e748.png "2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid")
2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid
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CAS No:
133961-81-6
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Formula:
C17H15ClO3S
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Chemical Name:
2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid
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Synonyms:
2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid;[[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio]acetic acid;Acetic acid, [[3-(4-chlorophenyl)-3-oxo-1-phenylpropyl]thio]- (9CI);Acetic acid, 2-[[3-(4-chlorophenyl)-3-oxo-1-phenylpropyl]thio]-;GKJHKTABFYRMPR-UHFFFAOYSA-N
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CAS No:
2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid Basic Attributes
334.8172
334.043
DTXSID80369521
Computed Properties
Molecular Weight:334.8
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:334.0430432
Monoisotopic Mass:334.0430432
Topological Polar Surface Area:79.7
Heavy Atom Count:22
Complexity:374
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-{[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]thio}acetic acid
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