4-Damp methiodide

Base Information

• Chemical Name: 4-Damp methiodide
• CAS No.: 1952-15-4
• Molecular Formula: C21H26 N O2 . I
• Molecular Weight: 451.347
• Hs Code.: 2933399090
• UNII: CP6GVV66RG
• DSSTox Substance ID: DTXSID40941281
• Wikipedia: 4-DAMP
• Wikidata: Q27140443
• Pharos Ligand ID: 5Z22YAM2BM3J
• ChEMBL ID: CHEMBL76897
• Mol file: 1952-15-4.mol

Synonyms:1-dimethyl-4-diphenylacetoxypiperidinium;4-DAMP;4-DAMP methiodide;4-DAMP methobromide;4-diphenylacetoxy-1,1-dimethylpiperidinium;4-diphenylacetoxy-1,1-dimethylpiperidinium iodide;4-diphenylacetoxy-N-methylpiperidine methiodide

Chemical Property of 4-Damp methiodide

Chemical Property:

• Melting Point: 211-213℃
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 26.30000
• Density: g/cm³
• LogP: 0.56330
• Storage Temp.: Store at RT
• Solubility.: H2O: 3 mg/mL
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 451.10083
• Heavy Atom Count: 25
• Complexity: 380

Purity/Quality:

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

4-DAMP ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+]1(CCC(CC1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C.[I-]
• Uses: 4-DAMP is a potent muscarinic M3 receptor antagonist.

Technology Process of 4-Damp methiodide

There total 3 articles about 4-Damp methiodide 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:

N-methyl-4-hydroxypiperidine (106-52-5) → 4-diphenylacetoxy-N-methylpiperidine methiodide (1952-15-4)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene; pyridine

2: diethyl ether

With pyridine; diethyl ether; benzene;

DOI:10.1021/jo01124a010

Reference yield:

diphenylacetic acid chloride (1871-76-7) → 4-diphenylacetoxy-N-methylpiperidine methiodide (1952-15-4)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene; pyridine

2: diethyl ether

With pyridine; diethyl ether; benzene;

DOI:10.1021/jo01124a010

Reference yield:

4-diphenyl acetoxy N-methyl piperidine (97762-23-7) + methyl iodide (74-88-4) → 4-diphenylacetoxy-N-methylpiperidine methiodide (1952-15-4)

Guidance literature:

With diethyl ether;

DOI:10.1021/jo01124a010

upstream raw materials:

4-diphenyl acetoxy N-methyl piperidine

methyl iodide

N-methyl-4-hydroxypiperidine

diphenylacetic acid chloride

Downstream raw materials:

4-Diphenylacetoxy-N-dimethylpiperidinium p-Toluolsulfonat