2-(2,4,6-Triiodophenoxy)butanoic acid
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2-(2,4,6-Triiodophenoxy)butanoic acid
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CAS No:
554-24-5
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Formula:
C10H9I3O3
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Chemical Name:
2-(2,4,6-Triiodophenoxy)butanoic acid
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Synonyms:
Butanoic acid,2-(2,4,6-triiodophenoxy)-;Butyric acid,2-(2,4,6-triiodophenoxy)-;2-(2,4,6-Triiodophenoxy)butanoic acid;4114 Th;Biliodyl;Phenobutiodil;2-(2,4,6-Triiodophenoxy)butyric acid;α-(2,4,6-Triiodophenoxy)butyric acid;Vesipaque;Trijobil;Baygnostil;Cholognost;Felotrast
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CAS No:
Characteristics
46.5
3.74240
2.488g/cm3
124.5 °C
529.1ºC at 760mmHg
273.8ºC
1.704
LD50 in mice (mg/kg): 1800 orally; 265 i.v. (Bekker)
Computed Properties
Molecular Weight:557.89
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:557.7686
Monoisotopic Mass:557.7686
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Complexity:238
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(2,4,6-Triiodophenoxy)butanoic acid
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