3-Amino-4-[[(Z)-4-[4-(Piperidin-1-Ylmethyl)Pyridin-2-Yl]Oxybut-2-Enyl]Amino]Cyclobut-3-Ene-1,2-Dione Hydrochloride
[CAS# 126463-66-9]

Identification

• Name: 3-Amino-4-[[(Z)-4-[4-(Piperidin-1-Ylmethyl)Pyridin-2-Yl]Oxybut-2-Enyl]Amino]Cyclobut-3-Ene-1,2-Dione Hydrochloride
• Synonyms: 3-Amino-4-[[(Z)-4-[[4-(1-Piperidylmethyl)-2-Pyridyl]Oxy]But-2-Enyl]Amino]Cyclobut-3-Ene-1,2-Dione Hydrochloride; 3-Amino-4-[[(Z)-4-[[4-(Piperidinomethyl)-2-Pyridyl]Oxy]But-2-Enyl]Amino]Cyclobut-3-Ene-1,2-Quinone Hydrochloride; D01861
• Molecular Formula: C₁₉H₂₅ClN₄O₃
• Molecular Weight: 392.88
• CAS Registry Number: 126463-66-9
• SMILES: [H+].C2=C(CN1CCCCC1)C=CN=C2OC\C=C/CNC3=C(N)C(=O)C3=O.[Cl-]
• InChI: 1S/C19H24N4O3.ClH/c20-16-17(19(25)18(16)24)22-7-2-5-11-26-15-12-14(6-8-21-15)13-23-9-3-1-4-10-23;/h2,5-6,8,12,22H,1,3-4,7,9-11,13,20H2;1H/b5-2-
• InChIKey: ODBOENMSSFCACZ-PVOKDAACSA-N

Properties

• Boiling point: 531.3°C at 760 mmHg (Cal.)
• Flash point: 275.1°C (Cal.)