3-[(2-Trityl-2H-tetrazol-5-yl)methyl]phenol
[CAS# 885278-40-0]

Identification

• Name: 3-[(2-Trityl-2H-tetrazol-5-yl)methyl]phenol
• Synonyms: 3-(2-TRITYL-2H-TETRAZOL-5-YLMETHYL)-PHENOL; 3-[(2-Trityl-2H-tetrazol-5-yl)methyl]phenol; 3-[(2-Trityl-2H-tetrazol-5-yl)methyl]phenol
• Molecular Formula: C₂₇H₂₂N₄O
• Molecular Weight: 418.49
• CAS Registry Number: 885278-40-0
• SMILES: c1ccc(cc1)C(c2ccccc2)(c3ccccc3)n4nc(nn4)Cc5cccc(c5)O
• InChI: 1S/C27H22N4O/c32-25-18-10-11-21(19-25)20-26-28-30-31(29-26)27(22-12-4-1-5-13-22,23-14-6-2-7-15-23)24-16-8-3-9-17-24/h1-19,32H,20H2
• InChIKey: ANDFDFQROBZCLI-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 654.1±65.0°C at 760 mmHg (Cal.)
• Flash point: 349.4±34.3°C (Cal.)
• Refractive index: 1.653 (Cal.)