Congocidine
[CAS# 63770-20-7]

Identification

• Name: Congocidine
• Synonyms: 4-[[4-[(1-Amino-2-Guanidino-Ethylidene)Amino]-1-Methyl-Pyrrole-2-Carbonyl]Amino]-N-(3-Amino-3-Oxo-Propyl)-1-Methyl-Pyrrole-2-Carboxamide Hydrochloride; 4-[[[4-[(1-Amino-2-Guanidinoethylidene)Amino]-1-Methyl-2-Pyrrolyl]-Oxomethyl]Amino]-N-(3-Amino-3-Oxopropyl)-1-Methyl-2-Pyrrolecarboxamide Hydrochloride; 4-[[4-[(1-Amino-2-Guanidino-Ethylidene)Amino]-1-Methyl-Pyrrole-2-Carbonyl]Amino]-N-(3-Amino-3-Keto-Propyl)-1-Methyl-Pyrrole-2-Carboxamide Hydrochloride
• Molecular Formula: C₁₈H₂₇ClN₁₀O₃
• Molecular Weight: 466.93
• CAS Registry Number: 63770-20-7 (1438-30-8)
• SMILES: [H+].C1=C([N](C=C1NC(=O)C2=CC(=C[N]2C)N=C(N)CN=C(N)N)C)C(=O)NCCC(=O)N.[Cl-]
• InChI: 1S/C18H26N10O3.ClH/c1-27-9-11(6-12(27)16(30)23-4-3-15(20)29)26-17(31)13-5-10(8-28(13)2)25-14(19)7-24-18(21)22;/h5-6,8-9H,3-4,7H2,1-2H3,(H2,19,25)(H2,20,29)(H,23,30)(H,26,31)(H4,21,22,24);1H
• InChIKey: QZOOZUGORDEYCC-UHFFFAOYSA-N

Properties

• Boiling point: 724.2°C at 760 mmHg (Cal.)
• Flash point: 391.8°C (Cal.)