1-Methyl-5-((3-(3-(1-Piperidinylmethyl)Phenoxy)Propyl)Amino)-1H-1,2,4-Triazole-3-Carboxylic Acid
[CAS# 80343-52-8]

Identification

• Name: 1-Methyl-5-((3-(3-(1-Piperidinylmethyl)Phenoxy)Propyl)Amino)-1H-1,2,4-Triazole-3-Carboxylic Acid
• Synonyms: 1-Methyl-5-[3-[3-(1-Piperidylmethyl)Phenoxy]Propylamino]-1,2,4-Triazole-3-Carboxylic Acid; 1-Methyl-5-[3-[3-(Piperidinomethyl)Phenoxy]Propylamino]-1,2,4-Triazole-3-Carboxylic Acid; 1-Methyl-5-((3-(3-(1-Piperidinylmethyl)Phenoxy)Propyl)Amino)-1H-1,2,4-Triazole-3-Carboxylic Acid
• Molecular Formula: C₁₉H₂₇N₅O₃
• Molecular Weight: 373.45
• CAS Registry Number: 80343-52-8
• SMILES: C2=C(OCCCNC1=NC(=N[N]1C)C(=O)O)C=CC=C2CN3CCCCC3
• InChI: 1S/C19H27N5O3/c1-23-19(21-17(22-23)18(25)26)20-9-6-12-27-16-8-5-7-15(13-16)14-24-10-3-2-4-11-24/h5,7-8,13H,2-4,6,9-12,14H2,1H3,(H,25,26)(H,20,21,22)
• InChIKey: FVXKKIQNOGUXPY-UHFFFAOYSA-N

Properties

• Density: 1.293g/cm³ (Cal.)
• Boiling point: 600.087°C at 760 mmHg (Cal.)
• Flash point: 316.721°C (Cal.)