(1H-Indol-2-yl)-N,N,N-trimethylmethanaminium iodide

Base Information

• Chemical Name: (1H-Indol-2-yl)-N,N,N-trimethylmethanaminium iodide
• CAS No.: 6639-23-2
• Molecular Formula: C₁₂H₁₇N₂*I
• Molecular Weight: 316.185
• DSSTox Substance ID: DTXSID70464897
• NSC Number: 16032
• Mol file: 6639-23-2.mol

Synonyms:6639-23-2;(1H-Indol-2-yl)-N,N,N-trimethylmethanaminium iodide;SCHEMBL9470116;DTXSID70464897;NSC16032;NSC-16032

Chemical Property of (1H-Indol-2-yl)-N,N,N-trimethylmethanaminium iodide

Chemical Property:

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 316.04365
• Heavy Atom Count: 15
• Complexity: 195

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+](C)(C)CC1=CC2=CC=CC=C2N1.[I-]

Technology Process of (1H-Indol-2-yl)-N,N,N-trimethylmethanaminium iodide

There total 1 articles about (1H-Indol-2-yl)-N,N,N-trimethylmethanaminium 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:

2-mercaptoethylamine hydrochloride (156-57-0) → indol-2-ylmethyl-trimethyl-ammonium; iodide (6639-23-2)

Guidance literature:

In methanol; for 1h; Ambient temperature;

DOI:10.1021/jm00141a017

Reference yield:

indol-2-ylmethyl-trimethyl-ammonium; iodide (6639-23-2) → N-cyano-N-<2-<(1H-indol-2-ylmethyl)thio>ethyl>-N'-phenylthiourea (78131-22-3)

Guidance literature:

Multi-step reaction with 2 steps

1: methanol / 1.) RT, 3 h, 2.) reflux, 16 h

2: 70 percent / 1,2-dimethoxy-ethane / 16 h / Ambient temperature

In methanol; 1,2-dimethoxyethane;

DOI:10.1021/jm00141a017

Reference yield:

indol-2-ylmethyl-trimethyl-ammonium; iodide (6639-23-2) → 1H-indole-2-ethanamine (496-42-4)

Guidance literature:

Multi-step reaction with 2 steps

1: methanol

2: Raney nickel; ethanolic NH₃ / 90 °C / 88260.9 Torr / Hydrogenation

With methanol; ammonia; nickel;

DOI:10.1002/hlca.19570400715

upstream raw materials:

2-mercaptoethylamine hydrochloride

Downstream raw materials:

N-cyano-N-<2-<(1H-indol-2-ylmethyl)thio>ethyl>-N'-phenylthiourea

1H-indole-2-ethanamine