2-(5-chloro-1H-indol-3-yl)ethylazanium;chloride

Base Information

• Chemical Name: 2-(5-chloro-1H-indol-3-yl)ethylazanium;chloride
• CAS No.: 942-26-7
• Molecular Formula: C10H12Cl2N2
• Molecular Weight: 231.125
• Hs Code.: 2933990090
• Mol file: 942-26-7.mol

Synonyms:

Chemical Property of 2-(5-chloro-1H-indol-3-yl)ethylazanium;chloride

Chemical Property:

• Vapor Pressure: 7.61E-06mmHg at 25°C
• Melting Point: 290°C (dec.)
• Boiling Point: 375.7 °C at 760 mmHg
• Flash Point: 181 °C
• PSA: 41.81000
• LogP: 3.82480
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 230.0377538
• Heavy Atom Count: 14
• Complexity: 174

Purity/Quality:

99% ^*data from raw suppliers

5-Chlorotryptamine Hydrochloride >98.0%(N) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R22:Harmful if swallowed.; R36/38:Irritating to eyes and skin.
• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1Cl)C(=CN2)CC[NH3+].[Cl-]

Technology Process of 2-(5-chloro-1H-indol-3-yl)ethylazanium;chloride

There total 4 articles about 2-(5-chloro-1H-indol-3-yl)ethylazanium;chloride 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: 72.0%

3-(2-aminoethyl)-5-chloro-1H-indole-2-carboxylic acid (103795-47-7) → 5-chlorotryptamine hydrochloride (942-26-7,55747-73-4)

Guidance literature:

With hydrogenchloride; for 2h; Heating;

DOI:10.1021/jm00051a007

Reference yield:

4-chloro-1-hydroxy-1-butanesulfonate sodium (54322-20-2) + 4-chlorophenylhydrazine hydrochloride (1073-70-7) → 5-chlorotryptamine hydrochloride (942-26-7,55747-73-4)

Guidance literature:

With disodium hydrogenphosphate; In ethanol; water; at 75 ℃; for 6h; pH=6 - 7;

Reference yield:

piperidine-2,3-dione-3-(4-chloro-phenylhydrazone) (91089-98-4) → 5-chlorotryptamine hydrochloride (942-26-7,55747-73-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 87 percent / 90percent aq. HCOOH / 1 h / Heating

2: 100 percent / KOH / ethanol / 6 h / Heating

3: 72 percent / 10percent aq. HCl / 2 h / Heating

With hydrogenchloride; potassium hydroxide; formic acid; In ethanol;

DOI:10.1021/jm00051a007

upstream raw materials:

3-(2-aminoethyl)-5-chloro-1H-indole-2-carboxylic acid

piperidine-2,3-dione-3-(4-chloro-phenylhydrazone)

6-chloro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-one

4-chloro-1-hydroxy-1-butanesulfonate sodium

Downstream raw materials:

2-[5-Chloro-1-(2,5-dimethyl-benzyl)-1H-indol-3-yl]-ethylamine

6-chloro-1-(3,4-dimethoxy-benzyl)-2,3,4,9-tetrahydro-1H-β-carboline

6-chloro-1,2,3,4-tetrahydro-β-carboline

8-amino-6-chloro-β-carboline

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