Dibrompropamidine Isetionate
[CAS# 614-87-9]

Identification

• Classification: Chemical reagent >> Organic reagent >> Imine, amidine
• Name: Dibrompropamidine Isetionate
• Synonyms: 3-Bromo-4-[3-(2-Bromo-4-Carbamimidoyl-Phenoxy)Propoxy]Benzamidine; 2-Hydroxyethanesulfonic Acid; 3-Bromo-4-[3-(2-Bromo-4-Carbamimidoylphenoxy)Propoxy]Benzamidine; 2-Hydroxyethanesulfonic Acid; 4-[3-(4-Amidino-2-Bromo-Phenoxy)Propoxy]-3-Bromo-Benzamidine; 2-Hydroxyethanesulfonic Acid
• Molecular Formula: C₁₉H₂₄Br₂N₄O₆S
• Molecular Weight: 596.29
• CAS Registry Number: 614-87-9
• EINECS: 210-399-5
• SMILES: C1=C(C=CC(=C1Br)OCCCOC2=C(Br)C=C(C=C2)C(=N)N)C(=N)N.C([S](=O)(=O)O)CO
• InChI: 1S/C17H18Br2N4O2.C2H6O4S/c18-12-8-10(16(20)21)2-4-14(12)24-6-1-7-25-15-5-3-11(17(22)23)9-13(15)19;3-1-2-7(4,5)6/h2-5,8-9H,1,6-7H2,(H3,20,21)(H3,22,23);3H,1-2H2,(H,4,5,6)
• InChIKey: BZACJASHKPPTKX-UHFFFAOYSA-N

Properties

• Boiling point: 570.9°C at 760 mmHg (Cal.)
• Flash point: 299.1°C (Cal.)