5-(Difluoromethanesulfonyl)-2-{2-[1-(3-methoxy-3-oxopropyl)-2-phenyl-1H-indol-3-yl]ethenyl}-1,3,3-trimethyl-3H-indol-1-ium iodide

Base Information

• Chemical Name: 5-(Difluoromethanesulfonyl)-2-{2-[1-(3-methoxy-3-oxopropyl)-2-phenyl-1H-indol-3-yl]ethenyl}-1,3,3-trimethyl-3H-indol-1-ium iodide
• CAS No.: 85050-04-0
• Molecular Formula: C32H31F2IN2O4S
• Molecular Weight: 704.5658164
• DSSTox Substance ID: DTXSID301005418
• Mol file: 85050-04-0.mol

Synonyms:DTXSID301005418;5-(Difluoromethanesulfonyl)-2-{2-[1-(3-methoxy-3-oxopropyl)-2-phenyl-1H-indol-3-yl]ethenyl}-1,3,3-trimethyl-3H-indol-1-ium iodide

Chemical Property of 5-(Difluoromethanesulfonyl)-2-{2-[1-(3-methoxy-3-oxopropyl)-2-phenyl-1H-indol-3-yl]ethenyl}-1,3,3-trimethyl-3H-indol-1-ium iodide

Chemical Property:

• PSA: 76.76000
• LogP: 4.63070
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 704.10173
• Heavy Atom Count: 42
• Complexity: 1130

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2=C(C=CC(=C2)S(=O)(=O)C(F)F)[N+](=C1C=CC3=C(N(C4=CC=CC=C43)CCC(=O)OC)C5=CC=CC=C5)C)C.[I-]