2-(Difluoromethyl)-5-methyl-1,3-benzoxazole

Base Information

Chemical Name:2-(Difluoromethyl)-5-methyl-1,3-benzoxazole
CAS No.:91437-10-4
Molecular Formula:C₉H₇F₂NO
Molecular Weight:183.157
Hs Code.:2934999090
DSSTox Substance ID:DTXSID80538513
Nikkaji Number:J2.450.593F
Wikidata:Q82413937
Mol file:91437-10-4.mol

Synonyms:91437-10-4;2-(Difluoromethyl)-5-methyl-1,3-benzoxazole;2-(Difluoromethyl)-5-methylbenzo[d]oxazole;SCHEMBL19733285;DTXSID80538513;VIKAKWARTNDSIA-UHFFFAOYSA-N

Suppliers and Price of 2-(Difluoromethyl)-5-methyl-1,3-benzoxazole

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

Alichem
2-(Difluoromethyl)-5-methylbenzo[d]oxazole
1g
$ 1793.10

Alichem
2-(Difluoromethyl)-5-methylbenzo[d]oxazole
500mg
$ 1075.13

Alichem
2-(Difluoromethyl)-5-methylbenzo[d]oxazole
250mg
$ 813.15

Total 4 raw suppliers

Chemical Property of 2-(Difluoromethyl)-5-methyl-1,3-benzoxazole

Chemical Property:

PSA：26.03000
LogP:3.07380
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:183.04957017
Heavy Atom Count:13
Complexity:189

Purity/Quality:

99%+ ^*data from raw suppliers

2-(Difluoromethyl)-5-methylbenzo[d]oxazole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC2=C(C=C1)OC(=N2)C(F)F

Technology Process of 2-(Difluoromethyl)-5-methyl-1,3-benzoxazole

There total 2 articles about 2-(Difluoromethyl)-5-methyl-1,3-benzoxazole 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: 99.0%

: 381-73-7
Difluoroacetic acid

: 95-84-1
3-amino-4-hydroxytoluene

: 91437-10-4
2-(difluoromethyl)-5-methylbenzo[d]oxazole

Guidance literature:: With triethylamine; triphenylphosphine; In tetrachloromethane; Heating;
DOI:10.1016/j.tetlet.2007.03.015

Reference yield: 72.0%

: 10531-78-9
5-methyl-1,3-benzoxazole

: 65864-64-4
trimethyl(difluoromethyl)silane

: 91437-10-4
2-(difluoromethyl)-5-methylbenzo[d]oxazole

Guidance literature:: With potassium tert-butylate; copper(l) cyanide; 9,10-phenanthrenequinone; In 1-methyl-pyrrolidin-2-one; at 20 ℃; for 6h; regioselective reaction; Inert atmosphere; Glovebox;
DOI:10.1021/jacs.8b08135