2-[1-(2,4,6-Triisopropylphenyl)sulfonyl-5-tetrazolyl]pyridine
[CAS# 81186-95-0]

Identification

• Name: 2-[1-(2,4,6-Triisopropylphenyl)sulfonyl-5-tetrazolyl]pyridine
• Synonyms: 2-[1-(2,4,6-Triisopropylphenyl)Sulfonyltetrazol-5-Yl]Pyridine; 2-[1-(2,4,6-Triisopropylphenyl)Sulfonyl-5-Tetrazolyl]Pyridine; 2-[1-[2,4,6-Tri(Propan-2-Yl)Phenyl]Sulfonyl-1,2,3,4-Tetrazol-5-Yl]Pyridine
• Molecular Formula: C₂₁H₂₇N₅O₂S
• Molecular Weight: 413.54
• CAS Registry Number: 81186-95-0
• SMILES: C1=C(C(=C(C=C1C(C)C)C(C)C)[S]([N]2N=NN=C2C3=NC=CC=C3)(=O)=O)C(C)C
• InChI: 1S/C21H27N5O2S/c1-13(2)16-11-17(14(3)4)20(18(12-16)15(5)6)29(27,28)26-21(23-24-25-26)19-9-7-8-10-22-19/h7-15H,1-6H3
• InChIKey: SAMACTIGDXRVRF-UHFFFAOYSA-N

Properties

• Density: 1.255g/cm³ (Cal.)
• Boiling point: 555.228°C at 760 mmHg (Cal.)
• Flash point: 289.592°C (Cal.)