3-(1-Carbamimidamido-4-chloro-7-isoquinolinyl)benzoic acid hydrochloride (1:1)
[CAS# 223670-98-2]

Identification

• Name: 3-(1-Carbamimidamido-4-chloro-7-isoquinolinyl)benzoic acid hydrochloride (1:1)
• Molecular Formula: C₁₇H₁₄Cl₂N₄O₂
• Molecular Weight: 377.22
• CAS Registry Number: 223670-98-2
• SMILES: Cl.OC(=O)c1cccc(c1)c2ccc3c(Cl)cnc(NC(N)=N)c3c2
• InChI: 1S/C17H13ClN4O2.ClH/c18-14-8-21-15(22-17(19)20)13-7-10(4-5-12(13)14)9-2-1-3-11(6-9)16(23)24;/h1-8H,(H,23,24)(H4,19,20,21,22);1H
• InChIKey: SWURNHDNFQEFIW-UHFFFAOYSA-N

Properties

• Boiling point: 612.8°C at 760 mmHg (Cal.)
• Flash point: 324.4°C (Cal.)
• Refractive index: (Cal.)