3-Hydroxy-1-methylpyridinium bromide dimethylthiocarbamate (ester)

Base Information

• Chemical Name: 3-Hydroxy-1-methylpyridinium bromide dimethylthiocarbamate (ester)
• CAS No.: 67465-55-8
• Molecular Formula: C9H13BrN2OS
• Molecular Weight: 277.1813
• DSSTox Substance ID: DTXSID40986778

Synonyms:Ro 1-6293;3-Hydroxy-1-methylpyridinium bromide dimethylthiocarbamate (ester);Pyridinium, 3-hydroxy-1-methyl-, bromide, dimethylthiocarbamate (ester);67465-55-8;DTXSID40986778;LS-132638;3-[(DIMETHYLCARBAMOTHIOYL)OXY]-1-METHYLPYRIDIN-1-IUM BROMIDE

Chemical Property of 3-Hydroxy-1-methylpyridinium bromide dimethylthiocarbamate (ester)

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 275.99320
• Heavy Atom Count: 14
• Complexity: 185

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: C[N+]1=CC=CC(=C1)OC(=S)N(C)C.[Br-]

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