1-hexadecyl-Pyridinium chloride, mixt. with 2-butoxy-N-(2-(diethylamino)ethyl)-4-quinolinecarboxamide monohydrochloride and ethyl 4-aminobenzoate
[CAS# 75975-62-1]

Identification

• Name: 1-hexadecyl-Pyridinium chloride, mixt. with 2-butoxy-N-(2-(diethylamino)ethyl)-4-quinolinecarboxamide monohydrochloride and ethyl 4-aminobenzoate
• Synonyms: 4-Aminobenzoic Acid Ethyl Ester; 2-Butoxy-N-(2-Diethylaminoethyl)-4-Quinolinecarboxamide; 1-Hexadecylpyridin-1-Ium; Chloride; Hydrochloride; 4-Aminobenzoic Acid Ethyl Ester
• Molecular Formula: C₅₀H₇₉Cl₂N₅O₄
• Molecular Weight: 885.11
• CAS Registry Number: 75975-62-1
• SMILES: [N+]1(=CC=CC=C1)CCCCCCCCCCCCCCCC.[H+].C(OC2=CC(=C3C(=N2)C=CC=C3)C(=O)NCCN(CC)CC)CCC.[Cl-].[Cl-].C(OC(=O)C4=CC=C(N)C=C4)C
• InChI: 1S/C21H38N.C20H29N3O2.C9H11NO2.2ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3;1-2-12-9(11)7-3-5-8(10)6-4-7;;/h15,17-18,20-21H,2-14,16,19H2,1H3;8-11,15H,4-7,12-14H2,1-3H3,(H,21,24);3-6H,2,10H2,1H3;2*1H/q+1;;;;/p-1
• InChIKey: RODMTGVAYFKSFW-UHFFFAOYSA-M

Properties

• Boiling point: 496.3°C at 760 mmHg (Cal.)
• Flash point: 254°C (Cal.)