3'-Acetyl-3,5-Diiodothyronine
[CAS# 93800-43-2]

Identification

• Name: 3'-Acetyl-3,5-Diiodothyronine
• Synonyms: (2S)-3-[4-(3-Acetyl-4-Hydroxy-Phenoxy)-3,5-Diiodo-Phenyl]-2-Amino-Propanoic Acid; (2S)-3-[4-(3-Acetyl-4-Hydroxy-Phenoxy)-3,5-Diiodo-Phenyl]-2-Amino-Propionic Acid; (2S)-2-Amino-3-[4-(3-Ethanoyl-4-Hydroxy-Phenoxy)-3,5-Diiodo-Phenyl]Propanoic Acid
• Molecular Formula: C₁₇H₁₅I₂NO₅
• Molecular Weight: 567.12
• CAS Registry Number: 93800-43-2
• SMILES: [C@H](C(=O)O)(N)CC2=CC(=C(OC1=CC=C(C(=C1)C(=O)C)O)C(=C2)I)I
• InChI: 1S/C17H15I2NO5/c1-8(21)11-7-10(2-3-15(11)22)25-16-12(18)4-9(5-13(16)19)6-14(20)17(23)24/h2-5,7,14,22H,6,20H2,1H3,(H,23,24)/t14-/m0/s1
• InChIKey: SQPUZZAEFDULPR-AWEZNQCLSA-N

Properties

• Density: 2.01g/cm³ (Cal.)
• Boiling point: 591.366°C at 760 mmHg (Cal.)
• Flash point: 311.447°C (Cal.)