Benzoylcholine bromide

• Catalog Number: ACM24943600
• Product Name: Benzoylcholine bromide
• CAS: 24943-60-0
• Category: Heterocyclic Organic Compound
• Synonyms: 2-(Benzoyloxy)-N,N,N-trimethylethan-1-aminium bromide; 2-benzoyloxyethyl(trimethyl)azanium,bromide; AKOS015833010; 24943-60-0; Benzoylcholine Bromide; MFCD00059969; 2-(Benzoyloxy)-N,N,N-trimethylethanaminium bromide; CTK0I7096; BenzoylcholineBromide
• IUPAC Name: 2-benzoyloxyethyl(trimethyl)azanium;bromide
• Molecular Weight: 288.18
• Molecular Formula: C₁₂H₁₈BrNO₂
• Canonical SMILES: C[N+](C)(C)CCOC(=O)C1=CC=CC=C1.[Br-]
• InChI: InChI=1S/C12H18NO2.BrH/c1-13(2,3)9-10-15-12(14)11-7-5-4-6-8-11;/h4-8H,9-10H2,1-3H3;1H/q+1;/p-1
• InChI Key: UOWKZCQHFFILJX-UHFFFAOYSA-M
• Complexity: 202
• Covalently-Bonded Unit Count: 2
• Exact Mass: 287.052g/mol
• H-Bond Acceptor: 3
• Heavy Atom Count: 16
• Monoisotopic Mass: 287.052g/mol
• Rotatable Bond Count: 5
• Topological Polar Surface Area: 26.3A^2