2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid
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![2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/934cfc8e1d6c4c5c965d5defc5dee8f4.png "2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid")
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid
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CAS No:
13080-23-4
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Formula:
C13H14I3NO4
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Chemical Name:
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid
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Synonyms:
13080-23-4;BRN 2674730;2-(3-(N-Methylacetamido)-2,4,6-triiodophenoxy)butyric acid;BUTYRIC ACID, 2-(3-(N-METHYLACETAMIDO)-2,4,6-TRIIODOPHENOXY)-;DTXSID80926916;2-[3-(N-Methylacetylamino)-2,4,6-triiodophenoxy]butyric acid;2-{3-[Acetyl(methyl)amino]-2,4,6-triiodophenoxy}butanoic acid
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CAS No:
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenoxy]butanoic acid Basic Attributes
628.97 g/mol
628.8057 g/mol
Computed Properties
Molecular Weight:628.97
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:628.8057
Monoisotopic Mass:628.8057
Topological Polar Surface Area:66.8
Heavy Atom Count:21
Complexity:396
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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