1,2,3-Trimethyl-1H-indol-5-ylamine

Base Information

• Chemical Name: 1,2,3-Trimethyl-1H-indol-5-ylamine
• CAS No.: 143797-94-8
• Molecular Formula: C11H14N2
• Molecular Weight: 174.24200
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID00424646
• Wikidata: Q82237305
• Mol file: 143797-94-8.mol

Synonyms:1,2,3-Trimethyl-1H-indol-5-ylamine;143797-94-8;1,2,3-trimethyl-1H-indol-5-amine;1,2,3-trimethylindol-5-amine;SCHEMBL3114251;5-amino-1,2,3-trimethylindole;DTXSID00424646;QDLZBJGHQYCOQO-UHFFFAOYSA-N;5-Amino-1,2,3-trimethyl-1H-indole;AKOS000302461;A930251

Chemical Property of 1,2,3-Trimethyl-1H-indol-5-ylamine

Chemical Property:

• PSA: 30.95000
• LogP: 2.95850
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 174.115698455
• Heavy Atom Count: 13
• Complexity: 193

Purity/Quality:

98%min ^*data from raw suppliers

1,2,3-Trimethyl-1H-indol-5-ylamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N(C2=C1C=C(C=C2)N)C)C

Technology Process of 1,2,3-Trimethyl-1H-indol-5-ylamine

There total 5 articles about 1,2,3-Trimethyl-1H-indol-5-ylamine 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:

1,2,3-trimethyl-5-nitroindole (3484-21-7) → 1,2,3-trimethyl-1H-indol-5-ylamine (143797-94-8)

Guidance literature:

With sodium hydroxide; sodium dithionite;

DOI:10.1021/ja01104a029

Reference yield:

2,3-Dimethyl-5-nitro-1H-indole (21296-94-6) → 1,2,3-trimethyl-1H-indol-5-ylamine (143797-94-8)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium ethylate; ethanol; toluene / unter Entfernen des A_. und anschl. mit Methyljodid

2: Na₂S₂O₄; aq.-ethanolic NaOH

With sodium hydroxide; sodium dithionite; ethanol; sodium ethanolate; toluene;

DOI:10.1021/ja01104a029

Reference yield:

4-nitro-aniline (100-01-6,104810-17-5) → 1,2,3-trimethyl-1H-indol-5-ylamine (143797-94-8)

Guidance literature:

Multi-step reaction with 5 steps

1: hydrogenchloride; sodium nitrite

2: acetic acid / ethanol

3: hydrogenchloride / 12 h / Reflux

4: potassium hydroxide / acetone / 20 °C

5: sodium dithionite; sodium hydroxide / ethanol / 1 h / 80 °C

With hydrogenchloride; sodium dithionite; acetic acid; potassium hydroxide; sodium hydroxide; sodium nitrite; In ethanol; acetone;

DOI:10.1055/s-0031-1290565

upstream raw materials:

1,2,3-trimethyl-5-nitroindole

2,3-Dimethyl-5-nitro-1H-indole

4-nitro-aniline

4-nitrophenylhydrazone

Downstream raw materials:

(4-fluorophenyl)-7,8,9-trimethyl-4-phenyl-7H-pyrrolo[2,3-h]quinoline

4-(1,2,3-trimethyl-9-phenyl-3H-pyrrolo[3,2-f]quinolin-7-yl)phenyl fluoride

4-(1,2,3-trimethyl-9-phenyl-3H-pyrrolo[3,2-f]quinolin-7-yl)phenyl chloride

2-(4-chlorophenyl)-7,8,9-trimethyl-4-phenyl-7H-pyrrolo[2,3-h]quinoline