N-[(4-Benzoylphenyl)methyl]-N,N,4-trimethyl-3-oxopentan-1-aminium bromide

Base Information

• Chemical Name: N-[(4-Benzoylphenyl)methyl]-N,N,4-trimethyl-3-oxopentan-1-aminium bromide
• CAS No.: 184006-62-0
• Molecular Formula: C22H28 N O3 . Br
• Molecular Weight: 434.37
• DSSTox Substance ID: DTXSID00700412
• Mol file: 184006-62-0.mol

Synonyms:184006-62-0;N-[(4-Benzoylphenyl)methyl]-N,N,4-trimethyl-3-oxopentan-1-aminium bromide;(4-benzoylphenyl)methyl-dimethyl-(4-methyl-3-oxopentyl)azanium;bromide;DTXSID00700412;KRFYKNYEHQNWPD-UHFFFAOYSA-M

Chemical Property of N-[(4-Benzoylphenyl)methyl]-N,N,4-trimethyl-3-oxopentan-1-aminium bromide

Chemical Property:

• PSA: 43.37000
• LogP: 0.69720
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 417.13034
• Heavy Atom Count: 26
• Complexity: 441

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(=O)CC[N+](C)(C)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2.[Br-]