Isoquinolinium, 2-(3-(trimethylammonio)propyl)-, dibromide

Base Information

• Chemical Name: Isoquinolinium, 2-(3-(trimethylammonio)propyl)-, dibromide
• CAS No.: 4353-42-8
• Molecular Formula: C15H22Br2N2
• Molecular Weight: 390.1566
• DSSTox Substance ID: DTXSID20963022

Synonyms:IN 206;4353-42-8;Ammonium, (3-(isoquinolinio)propyl)trimethyl-, dibromide;ISOQUINOLINIUM, 2-(3-(TRIMETHYLAMMONIO)PROPYL)-, DIBROMIDE;Isoquinolinium, 2-[3-(trimethylammonio)propyl]-, dibromide;C15H22N2.2Br;DTXSID20963022;C15-H22-N2.2Br;LS-86158;2-[3-(Trimethylazaniumyl)propyl]isoquinolin-2-ium dibromide

Chemical Property of Isoquinolinium, 2-(3-(trimethylammonio)propyl)-, dibromide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 390.01292
• Heavy Atom Count: 19
• Complexity: 232

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+](C)(C)CCC[N+]1=CC2=CC=CC=C2C=C1.[Br-].[Br-]

Technology Process of Isoquinolinium, 2-(3-(trimethylammonio)propyl)-, dibromide

There total 1 articles about Isoquinolinium, 2-(3-(trimethylammonio)propyl)-, dibromide 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:

isoquinoline (119-65-3) + 3-(N,N,N-trimethylammonio)propyl bromide (131732-22-4) → 2-(3-trimethylammonio-propyl)-isoquinolinium; dibromide (4353-42-8)

Guidance literature:

With acetonitrile;

DOI:10.1021/ja01618a033

Reference yield:

2-(3-trimethylammonio-propyl)-isoquinolinium; dibromide (4353-42-8) → [3-(3,4-dihydro-1H-[2]isoquinolyl)-propyl]-trimethyl-ammonium; bromide hydrobromide (64047-68-3)

Guidance literature:

With methanol; platinum; Hydration;

DOI:10.1021/ja01618a033

upstream raw materials:

isoquinoline

3-(N,N,N-trimethylammonio)propyl bromide

Downstream raw materials:

[3-(3,4-dihydro-1H-[2]isoquinolyl)-propyl]-trimethyl-ammonium; bromide hydrobromide

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