2-Butyl-3-[[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]Benzimidazole-4-Carboxylic Acid
[CAS# 136284-47-4]

Identification

• Name: 2-Butyl-3-[[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]Benzimidazole-4-Carboxylic Acid
• Synonyms: 2-Butyl-3-[[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]-4-Benzimidazolecarboxylic Acid; 2-Butyl-3-[4-[2-(2H-Tetrazol-5-Yl)Phenyl]Benzyl]Benzimidazole-4-Carboxylic Acid; 2-Butyl-3-[[4-[2-(2H-1,2,3,4-Tetrazol-5-Yl)Phenyl]Phenyl]Methyl]Benzimidazole-4-Carboxylic Acid
• Molecular Formula: C₂₆H₂₄N₆O₂
• Molecular Weight: 452.51
• CAS Registry Number: 136284-47-4
• SMILES: C1=CC=C(C2=C1N=C([N]2CC5=CC=C(C4=C(C3=N[NH]N=N3)C=CC=C4)C=C5)CCCC)C(=O)O
• InChI: 1S/C26H24N6O2/c1-2-3-11-23-27-22-10-6-9-21(26(33)34)24(22)32(23)16-17-12-14-18(15-13-17)19-7-4-5-8-20(19)25-28-30-31-29-25/h4-10,12-15H,2-3,11,16H2,1H3,(H,33,34)(H,28,29,30,31)
• InChIKey: FLOKGHWIQFCIJW-UHFFFAOYSA-N

Properties

• Density: 1.346g/cm³ (Cal.)
• Boiling point: 772.1°C at 760 mmHg (Cal.)
• Flash point: 420.751°C (Cal.)