5-Bromo-1-ethyl-1H-indole

Base Information

• Chemical Name: 5-Bromo-1-ethyl-1H-indole
• CAS No.: 195253-49-7
• Molecular Formula: C10H10BrN
• Molecular Weight: 224.1
• Hs Code.: 2933990090
• European Community (EC) Number: 801-612-8
• DSSTox Substance ID: DTXSID40402685
• Nikkaji Number: J2.378.627C
• Wikidata: Q82206146
• Mol file: 195253-49-7.mol

Synonyms:5-BROMO-1-ETHYL-1H-INDOLE;195253-49-7;5-bromo-1-ethylindole;1-ethyl-5-bromo-1H-indole;SCHEMBL3478164;DTXSID40402685;LNBZVSDFWQIXHC-UHFFFAOYSA-N;VHA25349;MFCD04344211;AKOS015834781;DS-4753;CS-0152002;FT-0733085;D70718;A880150

Chemical Property of 5-Bromo-1-ethyl-1H-indole

Chemical Property:

• PSA: 4.93000
• LogP: 3.42370
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 222.99966
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

5-Bromo-1-ethyl-1H-indole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C=CC2=C1C=CC(=C2)Br

Technology Process of 5-Bromo-1-ethyl-1H-indole

There total 4 articles about 5-Bromo-1-ethyl-1H-indole 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: 99.0%

5-bromo-1H-indole (10075-50-0) + ethyl bromide (74-96-4) → 1-ethyl-5-bromo-1H-indole (195253-49-7)

Guidance literature:

With potassium hydroxide; In N,N-dimethyl-formamide; at 50 ℃; for 18h;

DOI:10.1016/j.tetlet.2016.11.090

Reference yield: 93.0%

5-bromo-1H-indole (10075-50-0) + ethyl iodide (75-03-6) → 1-ethyl-5-bromo-1H-indole (195253-49-7)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; for 6h; Heating;

DOI:10.1002/ardp.19973300506

Reference yield: 53.0%

5-bromo-1H-indole (10075-50-0) + ethyl trifluoroacetate, (383-63-1) → 1-ethyl-5-bromo-1H-indole (195253-49-7)

Guidance literature:

With potassium tert-butylate; In N,N-dimethyl-formamide; at 20 ℃; for 0.116667h; Microwave irradiation;

upstream raw materials:

5-bromo-1H-indole

ethyl iodide

ethyl bromide

ethyl trifluoroacetate,

Downstream raw materials:

(5-Bromo-1-ethyl-1H-indol-3-yl)-phenyl-methanone

(5-bromo-1-ethyl-1H-3-indolyl)(4-chlorophenyl)methanone

(5-Bromo-1-ethyl-1H-indol-3-yl)-phenyl-methanol

(5-bromo-1-ethyl-1H-3-indolyl)(4-chlorophenyl)methanol