3-[(4-Methoxyphenyl)methyl]-6-methyl-1,3-benzothiazol-3-ium bromide

Base Information

• Chemical Name: 3-[(4-Methoxyphenyl)methyl]-6-methyl-1,3-benzothiazol-3-ium bromide
• CAS No.: 89542-65-4
• Molecular Formula: C16H16NOS.Br
• DSSTox Substance ID: DTXSID40522736

Synonyms:89542-65-4;DTXSID40522736;3-[(4-Methoxyphenyl)methyl]-6-methyl-1,3-benzothiazol-3-ium bromide

Chemical Property of 3-[(4-Methoxyphenyl)methyl]-6-methyl-1,3-benzothiazol-3-ium bromide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 349.01360
• Heavy Atom Count: 20
• Complexity: 291

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)[N+](=CS2)CC3=CC=C(C=C3)OC.[Br-]

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