3,5-Diiodo-D-Thyronine
[CAS# 5563-89-3]

Identification

• Name: 3,5-Diiodo-D-Thyronine
• Synonyms: 2-Amino-3-[4-(4-Hydroxyphenoxy)-3,5-Diiodo-Phenyl]Propanoic Acid; 2-Amino-3-[4-(4-Hydroxyphenoxy)-3,5-Diiodo-Phenyl]Propionic Acid; To_000037
• Molecular Formula: C₁₅H₁₃I₂NO₄
• Molecular Weight: 525.08
• CAS Registry Number: 5563-89-3
• EINECS: 226-937-7
• SMILES: C1=C(CC(C(O)=O)N)C=C(C(=C1I)OC2=CC=C(C=C2)O)I
• InChI: 1S/C15H13I2NO4/c16-11-5-8(7-13(18)15(20)21)6-12(17)14(11)22-10-3-1-9(19)2-4-10/h1-6,13,19H,7,18H2,(H,20,21)
• InChIKey: ZHSOTLOTTDYIIK-UHFFFAOYSA-N

Properties

• Density: 2.1±0.1g/cm³ (Cal.)
• Boiling point: 559.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 292.1±30.1°C (Cal.)

References

• (1): Sasi S. Kannamkumarath, Rodolfo G. Wuilloud, Apryll Stalcup, Joseph A. Caruso, Himanshu Patel and Adel Sakr. Determination of levothyroxine and its degradation products in pharmaceutical tablets by HPLC-UV-ICP-MS, J. Anal. Atom. Spectrosc., 2004, 19, 107.