N-butyl-3-metylpyridinium bromide

• Catalog Number: ACM26576852
• Product Name: N-butyl-3-metylpyridinium bromide
• CAS: 26576-85-2
• Category: Pyridinium Ionic Liquids
• IUPAC Name: 1-butyl-3-methylpyridin-1-ium;bromide
• Molecular Weight: 230.14g/mol
• Molecular Formula: C10H16BrN
• Canonical SMILES: CCCC[N+]1=CC=CC(=C1)C.[Br-]
• InChI: InChI=1S/C10H16N.BrH/c1-3-4-7-11-8-5-6-10(2)9-11;/h5-6,8-9H,3-4,7H2,1-2H3;1H/q+1;/p-1
• InChI Key: GNPWBXOERPGDFI-UHFFFAOYSA-M
• Abbreviation: B3MePyBr
• Chemical Formula: B3MePyBr
• Complexity: 101
• Covalently-Bonded Unit Count: 2
• Exact Mass: 229.04661g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 12
• Monoisotopic Mass: 229.04661g/mol
• Rotatable Bond Count: 3