2-(Acetylamino)-4-(ethylsulfinyl)butanoic acid
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2-(Acetylamino)-4-(ethylsulfinyl)butanoic acid
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CAS No:
26108-79-2
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Formula:
C8H15NO4S
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Chemical Name:
2-(Acetylamino)-4-(ethylsulfinyl)butanoic acid
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Synonyms:
Butanoic acid,2-(acetylamino)-4-(ethylsulfinyl)-;Butyric acid,2-acetamido-4-(ethylsulfinyl)-;2-(Acetylamino)-4-(ethylsulfinyl)butanoic acid;N-Acetylethionine sulfoxide;2-Acetamido-4-ethylsulfinylbutanoic acid;57511-60-1
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CAS No:
Computed Properties
Molecular Weight:221.28
XLogP3:-1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:221.07217913
Monoisotopic Mass:221.07217913
Topological Polar Surface Area:103
Heavy Atom Count:14
Complexity:242
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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