2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]hexanoic acid
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![2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]hexanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/764c2c06cc90442a8aef542a1f0abcfa.png "2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]hexanoic acid")
2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]hexanoic acid
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CAS No:
24340-27-0
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Formula:
C16H20I3NO4
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Chemical Name:
2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]hexanoic acid
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Synonyms:
2-(3-(N-Methylpropionamido)-2,4,6-triiodophenoxy)hexanoic acid; HEXANOIC ACID,2-(3-(N-METHYLPROPIONAMIDO)-2,4,6-TRIIODOPHENOXY); 2-[3-(Methyl-propionyl-amino)-2,4,6-triiod-phenoxy]-capronsaeure;
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CAS No:
2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]hexanoic acid Basic Attributes
671.04800
670.8527 g/mol
2924299090
Computed Properties
Molecular Weight:671.05
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:670.8527
Monoisotopic Mass:670.8527
Topological Polar Surface Area:66.8
Heavy Atom Count:24
Complexity:438
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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