3-Carboxy-1-methylpyridinium methyl sulphate

Base Information

• Chemical Name: 3-Carboxy-1-methylpyridinium methyl sulphate
• CAS No.: 34452-78-3
• Molecular Formula: C8H11NO6S
• Molecular Weight: 249.2410
• European Community (EC) Number: 252-040-5
• DSSTox Substance ID: DTXSID70188026
• Mol file: 34452-78-3.mol

Synonyms:34452-78-3;3-Carboxy-1-methylpyridinium methyl sulphate;EINECS 252-040-5;3-Carboxy-1-methylpyridinium methyl sulfate;SCHEMBL11786615;DTXSID70188026;NS00087616

Chemical Property of 3-Carboxy-1-methylpyridinium methyl sulphate

Chemical Property:

• PSA: 115.99000
• LogP: 0.38310
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 249.03070824
• Heavy Atom Count: 16
• Complexity: 226

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+]1=CC=CC(=C1)C(=O)O.COS(=O)(=O)[O-]

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