2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenyl]butanoic acid
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![2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenyl]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/430cff1a0fc5488c8e091f4c42f4df5b.png "2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenyl]butanoic acid")
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenyl]butanoic acid
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CAS No:
23217-82-5
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Formula:
C13H14I3NO3
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Chemical Name:
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenyl]butanoic acid
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Synonyms:
23217-82-5;BRN 3037691;2-(3-(N-Methylacetamido)-2,4,6-triiodophenyl)butyric acid;BUTYRIC ACID, 2-(3-(N-METHYLACETAMIDO)-2,4,6-TRIIODOPHENYL)-;DTXSID00945902;2-{3-[Acetyl(methyl)amino]-2,4,6-triiodophenyl}butanoic acid;2-[2,4,6-Triiodo-3-[N-methyl(acetyl)amino]phenyl]butyric acid
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CAS No:
2-[3-[acetyl(methyl)amino]-2,4,6-triiodophenyl]butanoic acid Basic Attributes
612.97 g/mol
612.8108 g/mol
Computed Properties
Molecular Weight:612.97
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:612.8108
Monoisotopic Mass:612.8108
Topological Polar Surface Area:57.6
Heavy Atom Count:20
Complexity:380
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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