4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine

Base Information

Chemical Name:4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine
CAS No.:179062-06-7
Molecular Formula:C7H6F4N2
Molecular Weight:194.13000
Hs Code.:2921599090
DSSTox Substance ID:DTXSID40379040
Wikidata:Q82168702
Mol file:179062-06-7.mol

Synonyms:4-fluoro-5-(trifluoromethyl)benzene-1,2-diamine;179062-06-7;4,5-Diamino-2-fluorobenzotrifluoride;3,4-diamino-6-fluorobenzotrifluoride;SCHEMBL437730;1,2-Benzenediamine, 4-fluoro-5-(trifluoromethyl)-;DTXSID40379040;CL9313;MFCD04038250;AKOS022171846;PS-8297;CS-0157830;4-fluoro-5-(trifluoromethyl)-1,2-diaminobenzene;A881281

Suppliers and Price of 4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine

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

TRC
3,4-Diamino-6-fluorobenzotrifluoride
500mg
$ 305.00

SynQuest Laboratories
4,5-Diamino-2-fluorobenzotrifluoride 97%
1 g
$ 192.00

SynQuest Laboratories
4,5-Diamino-2-fluorobenzotrifluoride 97%
5 g
$ 660.00

Matrix Scientific
4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 95+%
250mg
$ 288.00

Matrix Scientific
4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 95+%
1g
$ 720.00

Crysdot
4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 98%
25g
$ 1515.00

Crysdot
4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 98%
10g
$ 842.00

Crysdot
4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 98%
5g
$ 480.00

Chemcia Scientific
4-Fluoro-5-trifluoromethyl-benzene-1,2-diamine 95%
1 G
$ 195.00

BLDpharm
4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 98%
25g
$ 1697.00

Total 13 raw suppliers

Chemical Property of 4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine

Chemical Property:

PSA：52.04000
LogP:3.17130
Storage Temp.:2-8°C(protect from light)
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:0
Exact Mass:194.04671085
Heavy Atom Count:13
Complexity:182

Purity/Quality:

97% ^*data from raw suppliers

3,4-Diamino-6-fluorobenzotrifluoride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C(=CC(=C1N)N)F)C(F)(F)F
Uses 3,4-Diamino-6-fluorobenzotrifluoride is a reagent used in the synthesis of orally efficacious benzimidazoles as melanin-concentrating hormone receptor 1 antagonists.

Technology Process of 4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine

There total 8 articles about 4-Fluoro-5-(trifluoromethyl)benzene-1,2-diamine 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: 95.0%

: 179062-05-6
4-fluoro-2-nitro-5-trifluoromethyl-aniline

: 179062-06-7
1,2-diamino-4-fluoro-5-trifluoromethylbenzene

Guidance literature:: palladium-carbon; In ethanol;

Reference yield:

: 428871-73-2
5-fluoro-2-nitro-4-(trifluoromethyl)aniline

: 179062-06-7
1,2-diamino-4-fluoro-5-trifluoromethylbenzene

Guidance literature:: With tin(ll) chloride; In ethanol; ethyl acetate; at 70 ℃; for 0.583333h;
DOI:10.1021/jm00022a003

Reference yield:

: 3-fluoro-4-trifluoromethylaniline

: 179062-06-7
1,2-diamino-4-fluoro-5-trifluoromethylbenzene

Guidance literature:: Multi-step reaction with 4 steps

1: 12 h / 25 °C

2: concd. H₂SO₄, concd. HNO₃ / 0 - 20 °C

3: concd. HCl / Heating

4: SnCl₂*H₂O / ethyl acetate; ethanol / 0.58 h / 70 °C

With hydrogenchloride; sulfuric acid; nitric acid; tin(ll) chloride; In ethanol; ethyl acetate;
DOI:10.1021/jm00022a003