3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid
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3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid
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CAS No:
5438-45-9
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Formula:
C10H10O4S
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Chemical Name:
3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid
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Synonyms:
Pyruvic acid, (4-hydroxy-3-methoxyphenyl)-2-thio-;5438-45-9;Benzenepropanoic acid, 4-hydroxy-3-methoxy-.alpha.-thioxo-;NSC16689;ZINC47620;DTXSID20280387;NSC-16689;2-Thioxo-3-(4-hydroxy-3-methoxyphenyl)propanoic acid;3-(4-hydroxy-3-methoxy-phenyl)-2-thioxo-propanoic acid;3-(4-Hydroxy-3-methoxyphenyl)-2-thioxopropanoic acid #
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CAS No:
3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid Basic Attributes
226.25 g/mol
226.02997997 g/mol
16689
DTXSID20280387
Computed Properties
Molecular Weight:226.25
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:226.02997997
Monoisotopic Mass:226.02997997
Topological Polar Surface Area:98.8
Heavy Atom Count:15
Complexity:254
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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