2-Phenyl-3-[1-(1H-Tetrazol-5-Yl)Ethylthio]-1H-Indole
[CAS# 66355-08-6]

Identification

• Name: 2-Phenyl-3-[1-(1H-Tetrazol-5-Yl)Ethylthio]-1H-Indole
• Synonyms: 2-Phenyl-3-[1-(2H-Tetrazol-5-Yl)Ethylthio]-1H-Indole; 2-Phenyl-3-[1-(2H-1,2,3,4-Tetrazol-5-Yl)Ethylsulfanyl]-1H-Indole; Lcs 22731
• Molecular Formula: C₁₇H₁₅N₅S
• Molecular Weight: 321.40
• CAS Registry Number: 66355-08-6
• SMILES: C1=CC=CC3=C1C(=C(C2=CC=CC=C2)[NH]3)SC(C4=N[NH]N=N4)C
• InChI: 1S/C17H15N5S/c1-11(17-19-21-22-20-17)23-16-13-9-5-6-10-14(13)18-15(16)12-7-3-2-4-8-12/h2-11,18H,1H3,(H,19,20,21,22)
• InChIKey: BQCWYQWISABPQK-UHFFFAOYSA-N

Properties

• Density: 1.406g/cm³ (Cal.)
• Boiling point: 592.716°C at 760 mmHg (Cal.)
• Flash point: 312.264°C (Cal.)