Thyromedan
[CAS# 57-65-8]

Identification

• Name: Thyromedan
• Synonyms: 2-Diethylaminoethyl 2-[3,5-Diiodo-4-(3-Iodo-4-Methoxy-Phenoxy)Phenyl]Acetate Hydrochloride; 2-[3,5-Diiodo-4-(3-Iodo-4-Methoxyphenoxy)Phenyl]Acetic Acid 2-Diethylaminoethyl Ester Hydrochloride; 2-[3,5-Diiodo-4-(3-Iodo-4-Methoxy-Phenoxy)Phenyl]Acetic Acid 2-Diethylaminoethyl Ester Hydrochloride
• Molecular Formula: C₂₁H₂₅ClI₃NO₄
• Molecular Weight: 771.60
• CAS Registry Number: 57-65-8
• SMILES: [H+].C1=C(CC(OCCN(CC)CC)=O)C=C(I)C(=C1I)OC2=CC(=C(OC)C=C2)I.[Cl-]
• InChI: 1S/C21H24I3NO4.ClH/c1-4-25(5-2)8-9-28-20(26)12-14-10-17(23)21(18(24)11-14)29-15-6-7-19(27-3)16(22)13-15;/h6-7,10-11,13H,4-5,8-9,12H2,1-3H3;1H
• InChIKey: MNIDQQFSKKUQGQ-UHFFFAOYSA-N

Properties

• Boiling point: 597.5°C at 760 mmHg (Cal.)
• Flash point: 315.1°C (Cal.)