2,4-dioxo-4-thiophen-3-ylbutanoic acid
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2,4-dioxo-4-thiophen-3-ylbutanoic acid
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CAS No:
105356-56-7
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Formula:
C8H6O4S
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Chemical Name:
2,4-dioxo-4-thiophen-3-ylbutanoic acid
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Synonyms:
CHEMBL179681;2,4-Dioxo-4-(thiophen-3-yl)butanoic acid;105356-56-7;BDBM50137858;3-Thiophenebutanoic acid, a,g-dioxo-;2,4-dioxo-4-(3-thienyl)butanoic acid;2,4-Dioxo-4-thiophen-3-yl-butyric acid
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CAS No:
Computed Properties
Molecular Weight:198.20
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:197.99867984
Monoisotopic Mass:197.99867984
Topological Polar Surface Area:99.7
Heavy Atom Count:13
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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