1,2-Dimethyl-1H-indole-3-ethylamine

Base Information

• Chemical Name: 1,2-Dimethyl-1H-indole-3-ethylamine
• CAS No.: 17726-03-3
• Molecular Formula: C12H16 N2
• Molecular Weight: 188.272
• Hs Code.: 2933990090
• European Community (EC) Number: 241-721-2
• DSSTox Substance ID: DTXSID80170275
• Nikkaji Number: J46.792H
• Wikidata: Q63409229
• Mol file: 17726-03-3.mol

Synonyms:17726-03-3;1,2-Dimethyl-1H-indole-3-ethylamine;2-(1,2-Dimethyl-1H-indol-3-yl)ethanamine;2-(1,2-dimethylindol-3-yl)ethanamine;2-(1,2-dimethyl-1H-indol-3-yl)ethan-1-amine;2-(1,2-Dimethyl-1H-indol-3-yl)-ethylamine;EINECS 241-721-2;1H-Indole-3-ethanamine, 1,2-dimethyl-;1,2-Dimethyltryptamine;ChemDiv2_005274;Oprea1_653698;SCHEMBL335711;dimethyl-1 H-indol-3-ethanamid;DTXSID80170275;HMS1383P16;STK114752;AKOS000302356;IDI1_003989;1,2-Dimethyl-1H-indole-3-(ethanamine);BB 0249617;EU-0052754;3-(2-AMINOETHYL)-1,2-DIMETHYLINDOLE;EN300-82410;2-(1,2-Dimethyl-1H-indol-3-yl)ethanamine #;2-(1,2-dimethyl-1H-indol-3-yl)-1-ethanamine;Q63409229

Chemical Property of 1,2-Dimethyl-1H-indole-3-ethylamine

Chemical Property:

• Vapor Pressure: 5.2E-05mmHg at 25°C
• Boiling Point: 348°Cat760mmHg
• Flash Point: 164.2°C
• PSA: 30.95000
• Density: 1.07g/cm³
• LogP: 2.68820
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 188.131348519
• Heavy Atom Count: 14
• Complexity: 193

Purity/Quality:

99% ^*data from raw suppliers

2-(1,2-dimethyl-1H-indol-3-yl)ethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=CC=CC=C2N1C)CCN

Technology Process of 1,2-Dimethyl-1H-indole-3-ethylamine

There total 7 articles about 1,2-Dimethyl-1H-indole-3-ethylamine 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: 69.0%

terf-Butyl (2-(1,2-dimethyl-1H-indol-3-yl)ethyl)carbamate → 2-(1,2-dimethyl-1H-indole-3-yl)ethylamine (17726-03-3)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 5 - 20 ℃; for 1h;

Reference yield:

1-chloro-4-pentyne (14267-92-6) → 2-(1,2-dimethyl-1H-indole-3-yl)ethylamine (17726-03-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 86 percent / (2,6-t-Bu-4-MePhO)2Ti(NMe₂)2 / toluene / 24 h / 100 °C

2: NaOH / H₂O / pH 9

With sodium hydroxide; (2,6-t-Bu-4-MePhO)2Ti(NMe₂)2; In water; toluene;

DOI:10.1016/j.tetlet.2004.02.085

Reference yield:

1-Methyl-1-phenylhydrazine (618-40-6) → 2-(1,2-dimethyl-1H-indole-3-yl)ethylamine (17726-03-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 86 percent / (2,6-t-Bu-4-MePhO)2Ti(NMe₂)2 / toluene / 24 h / 100 °C

2: NaOH / H₂O / pH 9

With sodium hydroxide; (2,6-t-Bu-4-MePhO)2Ti(NMe₂)2; In water; toluene;

DOI:10.1016/j.tetlet.2004.02.085

upstream raw materials:

1-chloro-4-pentyne

1-Methyl-1-phenylhydrazine

2-methyltryptamine

Downstream raw materials:

N-(2-(1,2-dimethyl-1H-indol-3-yl)ethyl)-4-methyl-N-(prop-2-ynyl)benzenesulfonamide