2-Amino-3-(trifluoromethyl)benzenethiol

Base Information

• Chemical Name: 2-Amino-3-(trifluoromethyl)benzenethiol
• CAS No.: 131105-90-3
• Molecular Formula: C₇H₆F₃NS
• Molecular Weight: 193.193
• DSSTox Substance ID: DTXSID601278654
• Mol file: 131105-90-3.mol

Synonyms:2-amino-3-(trifluoromethyl)benzenethiol;131105-90-3;GYYSBWSFSDFQEN-UHFFFAOYSA-N;DTXSID601278654;2-Amino-3-(trifluoromethyl)benzene-1-thiol;A935097

Chemical Property of 2-Amino-3-(trifluoromethyl)benzenethiol

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 193.01730486
• Heavy Atom Count: 12
• Complexity: 159

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)S)N)C(F)(F)F

Technology Process of 2-Amino-3-(trifluoromethyl)benzenethiol

There total 2 articles about 2-Amino-3-(trifluoromethyl)benzenethiol 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:

2-amino-6-trifluoromethyl-1,3-benzothiazole (777-12-8) → 2-Amino-3-trifluoromethyl-benzenethiol (131105-90-3)

Guidance literature:

With hydrazine hydrate; Ambient temperature;

DOI:10.1021/jm00105a018

Reference yield:

BrH*C8H5F3N2S (21418-40-6) → 2-Amino-3-trifluoromethyl-benzenethiol (131105-90-3)

Guidance literature:

BrH*C₈H₅F₃N₂S; With ammonia;

With potassium hydroxide;

With acetic acid;

DOI:10.1016/j.ejmech.2010.07.006

Reference yield: 82.0%

2-Amino-3-trifluoromethyl-benzenethiol (131105-90-3) + 3-(4-fluoro-2-methylbenzoyl)-2-propenoic acid → C18H13F4NO2S

Guidance literature:

With Montmorillonite KSF; for 0.05h; microwave irradiation;

DOI:10.1016/j.jfluchem.2007.01.003

upstream raw materials:

2-amino-6-trifluoromethyl-1,3-benzothiazole

BrH*C₈H₅F₃N₂S