Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride

Base Information

Chemical Name:Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride
CAS No.:96232-04-1
Molecular Formula:C7H6F3NS.ClH
Molecular Weight:229.653
Hs Code.:
DSSTox Substance ID:DTXSID80600800

Synonyms:96232-04-1;Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride;2-Amino-5-(trifluoromethyl)benzene-1-thiol hydrochloride;MFCD25969606;2-AMINO-5-(TRIFLUOROMETHYL)BENZENETHIOL HYDROCHLORIDE;2-amino-5-trifluoromethylbenzenethiol hydrochloride;SCHEMBL4183751;DTXSID80600800;AT19657;SY078592;EN300-204762;2-amino-5-(trifluoromethyl)benzenethiol;hydrochloride;2-Amino-5-(trifluoromethyl)benzene-1-thiolhydrochloride;2-Amino-5-(trifluoromethyl)benzene-1-thiol--hydrogen chloride (1/1)

Suppliers and Price of Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride

Chemical Property:

PSA：64.82000
LogP:3.95950
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:0
Exact Mass:228.9939826
Heavy Atom Count:13
Complexity:159

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1C(F)(F)F)S)N.Cl

Technology Process of Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride

There total 2 articles about Benzenethiol, 2-amino-5-(trifluoromethyl)-, hydrochloride 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: 89.0%

: 131106-70-2
6-(trifluoromethyl)benzo[d]thiazole

: 96232-04-1
2-amino-5-trifluoromethylbenzenethiol hydrochloride

Guidance literature:: With hydrazine hydrate; Ambient temperature;
DOI:10.1021/jm00105a018

Reference yield:

: 777-12-8
2-amino-6-trifluoromethyl-1,3-benzothiazole

: 96232-04-1
2-amino-5-trifluoromethylbenzenethiol hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaNO₂, 85percent H₃PO₄, 2.) hypophosphorous acid / 1.) water, 0 deg C, 30 min, 2.) RT

2: 89 percent / hydrazine hydrate / Ambient temperature

With phosphoric acid; hypophosphorous acid; hydrazine hydrate; sodium nitrite;
DOI:10.1021/jm00105a018