2,2',2''-(1,4,8,11-Tetraazacyclotetradecane-1,4,8-Triyl)Triacetamide Hydroiodide (1:1)
[CAS# 220554-75-6]

Identification

• Name: 2,2',2''-(1,4,8,11-Tetraazacyclotetradecane-1,4,8-Triyl)Triacetamide Hydroiodide (1:1)
• Synonyms: 1,4,8-TRIS(AMINOCARBONYLMETHYL)-1,4,8,11-TETRAAZACYCLOTETRADECANE MONOHYDRIODIDE; Cyclam-N,N',N"-triacetamide hydriodide; TETRAM
• Molecular Formula: C₁₆H₃₄IN₇O₃
• Molecular Weight: 499.39
• CAS Registry Number: 220554-75-6
• SMILES: C1CNCCN(CCCN(CCN(C1)CC(=O)N)CC(=O)N)CC(=O)N.I
• InChI: 1S/C16H33N7O3.HI/c17-14(24)11-21-6-2-7-23(13-16(19)26)10-9-22(12-15(18)25)5-1-3-20-4-8-21;/h20H,1-13H2,(H2,17,24)(H2,18,25)(H2,19,26);1H
• InChIKey: JSJFTBJBERXHTP-UHFFFAOYSA-N

Properties

• Melting point: 221-223°C (Expl.)
• Refractive index: (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: WARNING: Irritates lungs, eyes, skin