2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid
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![2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c17fe0334c31469398b6e1807ad0af82.png "2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid")
2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid
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CAS No:
21762-13-0
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Formula:
C13H12I3NO4
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Chemical Name:
2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid
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Synonyms:
21762-13-0;2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid;3-(3-Oxomorpholino)-2,4,6-triiodohydratropic acid sodium salt;DTXSID80944372;Hydratropic acid, 3-(3-oxomorpholino)-2,4,6-triiodo-, sodium salt
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CAS No:
2-[2,4,6-triiodo-3-(3-oxomorpholin-4-yl)phenyl]propanoic acid Basic Attributes
626.95 g/mol
626.7901 g/mol
Computed Properties
Molecular Weight:626.95
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:626.7901
Monoisotopic Mass:626.7901
Topological Polar Surface Area:66.8
Heavy Atom Count:21
Complexity:422
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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