HuagongsheHuagongshe Chemistry Print Report · For research reference only
Levothyroxine Related Compound (2-Acetamido-3-(3,5-diiodo-4-(4-methoxyphenoxy)phenyl) Propanoic Acid)
Levothyroxine Impurity 68 · Levothyroxine Sodium Impurity 10 · Alanine, N-acetyl-3-[3,5-diiodo-4-(p-methoxyphenoxy)phenyl]-, L- · Alanine, N-acetyl-3-[3,5-diiodo-4-(p-methoxyphenoxy)phenyl]-, L- (5CI) · Levothyroxine impurity 1/2-Acetamido-3-(3,5-diiodo-4-(4-methoxyphenoxy)phenyl) Propanoic Acid · Levothyroxine Related Compound (2-Acetamido-3-(3,5-diiodo-4-(4-methoxyphenoxy)phenyl) Propanoic Acid) · Levothyroxine Related Compound 8 (2-Acetamido-3-(3,5-diiodo-4-(4-methoxyphenoxy)phenyl) Propanoic Acid)

Identifiers & Physical Properties
| CAS No. | 886203-79-8 |
|---|---|
| Molecular formula | C18H17I2NO5 |
| Average molar mass | 581.14 g/mol |
| SMILES | COc1ccc(Oc2c(I)cc(C[C@H](NC(C)=O)C(=O)O)cc2I)cc1 |
| InChIKey | BFCLKBBUOZJXOQ-INIZCTEOSA-N |
Chemical & Physical Properties
| Melting point | 196-197 °C |
|---|---|
| Boiling point | 642.0±55.0 °C(Predicted) |
| Density | 1.865±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 2.99±0.10(Predicted) |