2-(2,5-dioxopyrrol-1-yl)-4-methylsulfanylbutanoic acid
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2-(2,5-dioxopyrrol-1-yl)-4-methylsulfanylbutanoic acid
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CAS No:
57079-10-4
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Formula:
C9H11NO4S
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Chemical Name:
2-(2,5-dioxopyrrol-1-yl)-4-methylsulfanylbutanoic acid
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Synonyms:
57079-10-4;2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-4-(methylsulfanyl)butanoic acid;N-maleoylmethionine;NSC266057;DTXSID60313042;BBL033726;STL373139;AKOS009375255;MCULE-2027507204;NSC-266057;VS-12240;2-(2,5-Dihydro-2,5-dioxo-1H-pyrrol-1-yl)-4-(methylthio)butyric acid;2-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)-4-(methylthio)butanoic acid
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CAS No:
2-(2,5-dioxopyrrol-1-yl)-4-methylsulfanylbutanoic acid Basic Attributes
229.26 g/mol
229.04087901 g/mol
266057
DTXSID60313042
Computed Properties
Molecular Weight:229.26
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:229.04087901
Monoisotopic Mass:229.04087901
Topological Polar Surface Area:100
Heavy Atom Count:15
Complexity:308
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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