5-chloro-N-(4-fluorophenyl)-2-nitro-1-benzothiophen-3-amine

Base Information

• Chemical Name: 5-chloro-N-(4-fluorophenyl)-2-nitro-1-benzothiophen-3-amine
• CAS No.: 149338-26-1
• Molecular Formula: C₁₄H₈ClFN₂O₂S
• Molecular Weight: 322.747
• DSSTox Substance ID: DTXSID50164242
• Nikkaji Number: J1.167.286H
• Wikidata: Q83033295
• Mol file: 149338-26-1.mol

Synonyms:149338-26-1;5-chloro-N-(4-fluorophenyl)-2-nitro-1-benzothiophen-3-amine;BRN 5826137;Benzo(b)thiophen-3-amine, 5-chloro-N-(4-fluorophenyl)-2-nitro-;5-Chloro-N-(4-fluorophenyl)-2-nitrobenzo(b)thiophen-3-amine;C14H8ClFN2O2S;DTXSID50164242;GSOBTPZMZQWOQV-UHFFFAOYSA-N;C14-H8-Cl-F-N2-O2-S;LS-41102;5-Chloro-N-(p-fluorophenyl)-2-nitrobenzo[b]thiophene-3-amine

Chemical Property of 5-chloro-N-(4-fluorophenyl)-2-nitro-1-benzothiophen-3-amine

Chemical Property:

• Vapor Pressure: 3.75E-09mmHg at 25°C
• Boiling Point: 474°Cat760mmHg
• PKA: 0.70±0.50(Predicted)
• Flash Point: 240.5°C
• PSA: 86.09000
• Density: 1.558g/cm³
• LogP: 5.94180
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 321.9979045
• Heavy Atom Count: 21
• Complexity: 390

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC2=C(SC3=C2C=C(C=C3)Cl)[N+](=O)[O-])F

Technology Process of 5-chloro-N-(4-fluorophenyl)-2-nitro-1-benzothiophen-3-amine

There total 2 articles about 5-chloro-N-(4-fluorophenyl)-2-nitro-1-benzothiophen-3-amine 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: 80.0%

5-chloro-3-bromo-2-nitro-benzothiophene (138993-25-6) + 4-fluoroaniline (371-40-4) → (5-Chloro-2-nitro-benzo[b]thiophen-3-yl)-(4-fluoro-phenyl)-amine (149338-26-1)

Guidance literature:

for 0.25h; Heating;

Reference yield:

3-bromo-5-chlorobenzo[b]thiophene (32969-26-9) → (5-Chloro-2-nitro-benzo[b]thiophen-3-yl)-(4-fluoro-phenyl)-amine (149338-26-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 22 percent / 90percent aq. nitric acid / acetic acid; acetic anhydride / 1.5 h / 20 °C

2: 80 percent / 0.25 h / Heating

With nitric acid; In acetic anhydride; acetic acid;

upstream raw materials:

5-chloro-3-bromo-2-nitro-benzothiophene

4-fluoroaniline

3-bromo-5-chlorobenzo[b]thiophene

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 149338-26-1 5-chloro-N-(4-fluorophenyl)-2-nitro-benzothiophen-3-amine

Send

Send

Metric Ton KG G Pound L ML

Send

Send