2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid
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![2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3567a95683c9425283e138f344df7b90.png "2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid")
2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid
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CAS No:
1229-52-3
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Formula:
C13H14I3NO4
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Chemical Name:
2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid
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Synonyms:
1229-52-3;BRN 2707381;2-(3-Butyramido-2,4,6-triiodophenoxy)propionic acid;DTXSID40924317;Propionic acid, 2-(3-butyramido-2,4,6-triiodophenoxy)-;alpha-(2,4,6-Trijod-3(n)-butyrylamino-phenoxy)-propionsaeure [German];2-[3-(Butyrylamino)-2,4,6-triiodophenoxy]propionic acid;alpha-(2,4,6-Trijod-3(n)-butyrylamino-phenoxy)-propionsaeure;2-{3-[(1-Hydroxybutylidene)amino]-2,4,6-triiodophenoxy}propanoic acid
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CAS No:
2-[3-(butanoylamino)-2,4,6-triiodophenoxy]propanoic acid Basic Attributes
628.97 g/mol
628.8057 g/mol
Computed Properties
Molecular Weight:628.97
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:628.8057
Monoisotopic Mass:628.8057
Topological Polar Surface Area:75.6
Heavy Atom Count:21
Complexity:382
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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