3-Monoiodothyronine
[CAS# 16170-92-6]

Identification

• Name: 3-Monoiodothyronine
• Synonyms: 2-Amino-3-[4-(4-Hydroxyphenoxy)-3-Iodo-Phenyl]Propanoic Acid; 2-Amino-3-[4-(4-Hydroxyphenoxy)-3-Iodo-Phenyl]Propionic Acid; 3-Monoiodothyronine
• Molecular Formula: C₁₅H₁₄INO₄
• Molecular Weight: 399.18
• CAS Registry Number: 16170-92-6 (29354-16-3)
• SMILES: C1=C(I)C(=CC=C1CC(N)C(=O)O)OC2=CC=C(O)C=C2
• InChI: 1S/C15H14INO4/c16-12-7-9(8-13(17)15(19)20)1-6-14(12)21-11-4-2-10(18)3-5-11/h1-7,13,18H,8,17H2,(H,19,20)
• InChIKey: SXQVOFSDWXYIRP-UHFFFAOYSA-N

Properties

• Density: 1.747g/cm³ (Cal.)
• Boiling point: 515.905°C at 760 mmHg (Cal.)
• Flash point: 265.81°C (Cal.)