3-Carboxy-1-methylpyridinium iodide ester with choline iodide

Base Information

• Chemical Name: 3-Carboxy-1-methylpyridinium iodide ester with choline iodide
• CAS No.: 108847-17-2
• Molecular Formula: C12H20 N2 O2 . 2 I
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID30910885
• Mol file: 108847-17-2.mol

Synonyms:108847-17-2;3-Carboxy-1-methylpyridinium iodide ester with choline iodide;Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide;trimethyl-[2-(1-methylpyridin-1-ium-3-carbonyl)oxyethyl]azanium;diiodide;trimethyl-[2-(1-methylpyridine-5-carbonyl)oxyethyl]azanium diiodide;DTXSID30910885;YUYNXVIZIZJRRU-UHFFFAOYSA-L;C12H20N2O2.2I;C12-H20-N2-O2.2I;LS-132339;1-Methyl-3-{[2-(trimethylazaniumyl)ethoxy]carbonyl}pyridin-1-ium diiodide

Chemical Property of 3-Carboxy-1-methylpyridinium iodide ester with choline iodide

Chemical Property:

• PSA: 29.54000
• LogP: -5.43280
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 477.96142
• Heavy Atom Count: 18
• Complexity: 236

Purity/Quality:

99% ，98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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