4-Azidobretylium tosylate

Base Information

• Chemical Name: 4-Azidobretylium tosylate
• CAS No.: 105959-93-1
• Molecular Formula: C18H23BrN4O3S
• Molecular Weight: 455.37
• DSSTox Substance ID: DTXSID20147441
• Mol file: 105959-93-1.mol

Synonyms:4-azido-2-bromo-N-ethyl-N,N-dimethylbenzenemethanaminium 4-methylbenzenesulfonate;4-azidobretylium tosylate

Chemical Property of 4-Azidobretylium tosylate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 115.33000
• Density: g/cm³
• LogP: 5.41986
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 454.06742
• Heavy Atom Count: 27
• Complexity: 466

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC[N+](C)(C)CC1=C(C=C(C=C1)N=[N+]=[N-])Br.CC1=CC=C(C=C1)S(=O)(=O)[O-]