1-Phenyl-2-[(2H-tetrazol-5-yl)sulfanyl]ethan-1-one

Base Information

• Chemical Name: 1-Phenyl-2-[(2H-tetrazol-5-yl)sulfanyl]ethan-1-one
• CAS No.: 61631-62-7
• Molecular Formula: C9H8N4OS
• DSSTox Substance ID: DTXSID70707837
• Nikkaji Number: J3.339.985E
• Mol file: 61631-62-7.mol

Synonyms:61631-62-7;1-Phenyl-2-[(2H-tetrazol-5-yl)sulfanyl]ethan-1-one;SCHEMBL8438111;DTXSID70707837;alpha-[(1H-Tetrazole-5-yl)thio]acetophenone;2-(1h-tetrazol-5-ylsulfanyl)-1-phenylethanone

Chemical Property of 1-Phenyl-2-[(2H-tetrazol-5-yl)sulfanyl]ethan-1-one

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 220.04188206
• Heavy Atom Count: 15
• Complexity: 220

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)CSC2=NNN=N2