Acetylcholine iodide

Base Information

• Chemical Name: Acetylcholine iodide
• CAS No.: 2260-50-6
• Molecular Formula: C7H16INO2
• Molecular Weight: 273.114
• Hs Code.: 29239000
• European Community (EC) Number: 218-862-3
• UNII: 7ZCP12S7HQ
• DSSTox Substance ID: DTXSID10883821
• Wikidata: Q27269074
• ChEMBL ID: CHEMBL60457
• Mol file: 2260-50-6.mol

Synonyms:2-(Acetyloxy)-N,N,N-trimethylethanaminium;Acetilcolina Cusi;Acetylcholine;Acetylcholine Bromide;Acetylcholine Chloride;Acetylcholine Fluoride;Acetylcholine Hydroxide;Acetylcholine Iodide;Acetylcholine L Tartrate;Acetylcholine L-Tartrate;Acetylcholine Perchlorate;Acetylcholine Picrate;Acetylcholine Picrate (1:1);Acetylcholine Sulfate (1:1);Bromide, Acetylcholine;Bromoacetylcholine;Chloroacetylcholine;Cusi, Acetilcolina;Fluoride, Acetylcholine;Hydroxide, Acetylcholine;Iodide, Acetylcholine;L-Tartrate, Acetylcholine;Miochol;Perchlorate, Acetylcholine

Chemical Property of Acetylcholine iodide

Chemical Property:

• Appearance/Colour: white crystalline powder
• Melting Point: 161-164 °C
• PSA: 26.30000
• Density: 1.4816 (estimate)
• LogP: -2.74030
• Storage Temp.: 2-8°C
• Sensitive.: Light Sensitive & Hygroscopic
• Water Solubility.: almost transparency
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 273.02258
• Heavy Atom Count: 11
• Complexity: 115

Purity/Quality:

98%,99%, ^*data from raw suppliers

Acetylcholine iodide 99+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCC[N+](C)(C)C.[I-]
• Uses: Acetylcholine is an endogenous neurotransmitter at cholinergic synapses that amplifies action potential of the sarcolemma thereby inducing muscle contractions. Acetylcholine iodide is used as an acetylcholine receptor agonist to identify, characterize and differentiate among types of cholinergic receptors. Acetylcholine iodide is used as a substrate to identify and characterize natural and mutated acetylcholinesterase(s).

Technology Process of Acetylcholine iodide

There total 2 articles about Acetylcholine iodide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

2',6'-dihydroxy-4'-methylacetophenone (1634-34-0) + choline iodide (17773-10-3) → acetylcholine iodide (2260-50-6)

Guidance literature:

at 65 ℃; for 2h; Temperature;

Reference yield:

2-iodoethyl acetate (627-10-1) + trimethylamine (75-50-3) → acetylcholine iodide (2260-50-6)

Guidance literature:

With diethyl ether;

Reference yield:

acetylcholine iodide (2260-50-6) → choline (62-49-7)

Guidance literature:

With human serum butyrylcholinesterase; In aq. buffer; pH=5; Reagent/catalyst; Kinetics; Enzymatic reaction;

DOI:10.1016/j.ab.2018.03.012

upstream raw materials:

2-iodoethyl acetate

trimethylamine

2',6'-dihydroxy-4'-methylacetophenone

choline iodide

Downstream raw materials:

choline iodide

acetylcholine picrate

choline

Refernces