3'-Bromo-3,5,5'-triiodothyronine
(2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid
Also Known As: Pseudo-T4|BrT3|3'-Bromo-T3|3'-Bromo-3,5,5'-triiodothyronine|3'-Brt3|Levothyroxine Impurity 38|3'-Bromo-3,5,5'-triiodo-L-thyronine|L-Tyrosine, O-(3-bromo-4-hydroxy-5-iodophenyl)-3,5-diiodo-|O-(3-Bromo-4-hydroxy-5-iodophenyl)-3,5-diiodotyrosine|(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-diiodo-L-tyrosine|(S)-2-amino-3-(4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl)propanoic acid
| Molecular Formula | C15H11BrI3NO4 |
|---|---|
| Molecular Weight | 728.7006 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 92.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 728.7006 |
| Monoisotopic Mass | 728.7006 |
| Heavy Atoms | 24 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 77667-01-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)Br)I)C[C@@H](C(=O)O)N |
| InChIKey | YSUYFSUSYJMLTH-LBPRGKRZSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3'-Bromo-3,5,5'-triiodothyronine (CAS 77667-01-7), with molecular formula C15H11BrI3NO4 and molecular weight 728.7006 g/mol. IUPAC: (2S)-2-amino-3-[4-(3-bromo-4-hydroxy-5-iodophenoxy)-3,5-diiodophenyl]propanoic acid.
3'-Bromo-3,5,5'-triiodothyronine is a custom synthesis product. We offer services from milligram to kilogram scale.
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