2-[(4-Nitrophenyl)thio]propanoic acid
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![2-[(4-Nitrophenyl)thio]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5982e812d1a24fc5ab868c185c3f0231.png "2-[(4-Nitrophenyl)thio]propanoic acid")
2-[(4-Nitrophenyl)thio]propanoic acid
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CAS No:
794582-38-0
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Formula:
C9H9NO4S
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Chemical Name:
2-[(4-Nitrophenyl)thio]propanoic acid
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Synonyms:
Propanoic acid,2-[(4-nitrophenyl)thio]-;2-[(4-Nitrophenyl)thio]propanoic acid;2-[(4-Nitrophenyl)sulfanyl]propanoic acid
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CAS No:
Computed Properties
Molecular Weight:227.24
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:227.02522894
Monoisotopic Mass:227.02522894
Topological Polar Surface Area:108
Heavy Atom Count:15
Complexity:245
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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