2-phenylsulfanylbutanedioic acid
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2-phenylsulfanylbutanedioic acid
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CAS No:
884-34-4
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Formula:
C10H10O4S
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Chemical Name:
2-phenylsulfanylbutanedioic acid
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Synonyms:
884-34-4;2-phenylsulfanylbutanedioic acid;2-(phenylsulfanyl)butanedioic acid;NSC70987;SCHEMBL10824817;DTXSID30290770;NSC-70987
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CAS No:
2-phenylsulfanylbutanedioic acid Basic Attributes
226.25 g/mol
226.02997997 g/mol
70987
DTXSID30290770
Computed Properties
Molecular Weight:226.25
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:226.02997997
Monoisotopic Mass:226.02997997
Topological Polar Surface Area:99.9
Heavy Atom Count:15
Complexity:236
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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