(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid
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![(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/080d2973a65843429770cc0196a1bb1c.png "(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid")
(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid
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CAS No:
77667-01-7
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Formula:
C15H11BrI3NO4
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Chemical Name:
(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid
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Synonyms:
3'-bromo-3,5,5'-triiodo-L-thyronine;3'-bromo-3,5,5'-triiodothyronine;3'-bromo-T3;3'-BrT3;BrT3;pseudo-T4;77667-01-7;BrT3;3'-Bromo-3,5,5'-triiodothyronine;Pseudo-T4;3'-Bromo-T3;3'-Brt3;3'-Bromo-3,5,5'-triiodo-L-thyronine;SCHEMBL2589236;DTXSID40998876;(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid;O-(3-Bromo-4-hydroxy-5-iodophenyl)-3,5-diiodotyrosine;L-Tyrosine, O-(3-bromo-4-hydroxy-5-iodophenyl)-3,5-diiodo-
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CAS No:
(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid Basic Attributes
729.87 g/mol
728.7006 g/mol
Computed Properties
Molecular Weight:729.87
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:728.7006
Monoisotopic Mass:728.7006
Topological Polar Surface Area:92.8
Heavy Atom Count:24
Complexity:435
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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