2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]butanoic acid
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![2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2e89e1c7513a4a748cdb071f8fe5cbb9.png "2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]butanoic acid")
2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]butanoic acid
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CAS No:
24340-24-7
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Formula:
C14H16I3NO4
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Chemical Name:
2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]butanoic acid
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Synonyms:
24340-24-7;BRN 2675627;2-(3-(N-Methylpropionamido)-2,4,6-triiodophenoxy)butyric acid;BUTYRIC ACID, 2-(3-(N-METHYLPROPIONAMIDO)-2,4,6-TRIIODOPHENOXY)-;DTXSID80947181;2-[3-(N-Methylpropionylamino)-2,4,6-triiodophenoxy]butyric acid;2-{2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy}butanoic acid
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CAS No:
2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]butanoic acid Basic Attributes
642.99 g/mol
642.8214 g/mol
Computed Properties
Molecular Weight:642.99
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:642.8214
Monoisotopic Mass:642.8214
Topological Polar Surface Area:66.8
Heavy Atom Count:22
Complexity:410
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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