6-Fluorobenzo[c][1,2,5]oxadiazol-5-amine

Base Information

Chemical Name:6-Fluorobenzo[c][1,2,5]oxadiazol-5-amine
CAS No.:504417-84-9
Molecular Formula:C6H4FN3O
Molecular Weight:153.11
Hs Code.:2934999090
DSSTox Substance ID:DTXSID00476201
Nikkaji Number:J1.823.363K
Wikidata:Q82307222
Mol file:504417-84-9.mol

Synonyms:504417-84-9;6-fluorobenzo[c][1,2,5]oxadiazol-5-amine;2,1,3-BENZOXADIAZOL-5-AMINE, 6-FLUORO-;DTXSID00476201

Suppliers and Price of 6-Fluorobenzo[c][1,2,5]oxadiazol-5-amine

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 2 raw suppliers

Chemical Property of 6-Fluorobenzo[c][1,2,5]oxadiazol-5-amine

Chemical Property:

PSA：64.94000
LogP:1.52530
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:0
Exact Mass:153.03383992
Heavy Atom Count:11
Complexity:157

Purity/Quality:: 99%+ ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C(=CC2=NON=C21)F)N

Technology Process of 6-Fluorobenzo[c][1,2,5]oxadiazol-5-amine

There total 4 articles about 6-Fluorobenzo[c][1,2,5]oxadiazol-5-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: 4.7%

: 504417-57-6
5-fluoro-6-nitro-2,1,3-benzoxadiazole

: 504417-84-9
5-amino-6-fluoro-2,1,3-benzoxadiazole

Guidance literature:: With hydrogenchloride; iron; In methanol; dichloromethane; at 20 ℃; for 0.25h;
DOI:10.3987/com-01-s(m)4

Reference yield:

: 367-81-7
2,4-dinitro-5-fluoroaniline

: 504417-84-9
5-amino-6-fluoro-2,1,3-benzoxadiazole

Guidance literature:: Multi-step reaction with 4 steps

1.1: conc. sulfuric acid; aq. sodium nitrite / acetic acid / 0 °C

1.2: aq. sodium azide / 1 h / 20 °C

2.1: 810 mg / ethyl acetate / 2.5 h / Heating

3.1: 52 percent / triphenylphosphine / ethyl acetate / 1 h / Heating

4.1: 4.7 percent / conc. hydrochloric acid; iron powder / CH₂Cl₂; methanol / 0.25 h / 20 °C

With hydrogenchloride; sulfuric acid; iron; triphenylphosphine; sodium nitrite; In methanol; dichloromethane; acetic acid; ethyl acetate;
DOI:10.3987/com-01-s(m)4

Reference yield:

: 5-fluoro-6-nitrobenzofuroxan

: 504417-84-9
5-amino-6-fluoro-2,1,3-benzoxadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 52 percent / triphenylphosphine / ethyl acetate / 1 h / Heating

2: 4.7 percent / conc. hydrochloric acid; iron powder / CH₂Cl₂; methanol / 0.25 h / 20 °C

With hydrogenchloride; iron; triphenylphosphine; In methanol; dichloromethane; ethyl acetate;
DOI:10.3987/com-01-s(m)4