Gapicomine
[CAS# 1539-39-5]

Identification

• Classification: API >> Circulatory system medication >> Prevention and treatment of angina pectoris
• Name: Gapicomine
• Synonyms: Citric Acid; 1-(4-Pyridyl)-N-(4-Pyridylmethyl)Methanamine; Bis(4-Pyridylmethyl)Amine; Citric Acid; 4,4'-(Iminodimethylene)Dipyridine Citrate
• Molecular Formula: C₁₈H₂₁N₃O₇
• Molecular Weight: 391.38
• CAS Registry Number: 1539-39-5
• SMILES: C(C(O)(C(=O)O)CC(=O)O)C(=O)O.C2=C(CNCC1=CC=NC=C1)C=CN=C2
• InChI: 1S/C12H13N3.C6H8O7/c1-5-13-6-2-11(1)9-15-10-12-3-7-14-8-4-12;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-8,15H,9-10H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
• InChIKey: GIFDOYWSLYYSDJ-UHFFFAOYSA-N

Properties

• Boiling point: 359.2°C at 760 mmHg (Cal.)
• Flash point: 171°C (Cal.)