2(3H)-Benzoxazolone, 6-chloro-3-methyl-

Base Information

Chemical Name:2(3H)-Benzoxazolone, 6-chloro-3-methyl-
CAS No.:50595-18-1
Molecular Formula:C8H6ClNO2
Molecular Weight:183.594
Hs Code.:
DSSTox Substance ID:DTXSID30357110
Wikidata:Q82136854

Synonyms:2(3H)-Benzoxazolone, 6-chloro-3-methyl-;50595-18-1;6-chloro-3-methyl-1,3-benzoxazol-2-one;6-chloro-N-methylbenzoxazolone;SCHEMBL5536572;DTXSID30357110;AKOS017350114

Suppliers and Price of 2(3H)-Benzoxazolone, 6-chloro-3-methyl-

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 2(3H)-Benzoxazolone, 6-chloro-3-methyl-

Chemical Property:

PSA：35.14000
LogP:1.78490
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:183.0087061
Heavy Atom Count:12
Complexity:209

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C2=C(C=C(C=C2)Cl)OC1=O

Technology Process of 2(3H)-Benzoxazolone, 6-chloro-3-methyl-

There total 2 articles about 2(3H)-Benzoxazolone, 6-chloro-3-methyl- 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: 44.0%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 76088-26-1
(6-Chloro-2-oxo-benzooxazol-3-ylmethyl)-triphenyl-phosphonium; chloride

: 50595-18-1
6-chloro-3-methylbenzo[d]oxazol-2(3H)-one

: 76088-28-3
6-chloro-3-vinylbenzoxazolinone

: 791-28-6
Triphenylphosphine oxide

Guidance literature:: With sodium carbonate; In chloroform; water; for 1h; Ambient temperature;
DOI:10.1007/BF00568378

Reference yield: 41.2%

: 76088-26-1
(6-Chloro-2-oxo-benzooxazol-3-ylmethyl)-triphenyl-phosphonium; chloride

: 50595-18-1
6-chloro-3-methylbenzo[d]oxazol-2(3H)-one

: 76088-28-3
6-chloro-3-vinylbenzoxazolinone

: 791-28-6
Triphenylphosphine oxide

Guidance literature:: With formaldehyd; sodium carbonate; In chloroform; water; for 1h; Ambient temperature;
DOI:10.1007/BF00568378

Reference yield: 78.0%

: 50595-18-1
6-chloro-3-methylbenzo[d]oxazol-2(3H)-one

: 66107-29-7
4-methoxyphenyl triflate

: 6-(4-methoxyphenyl)-3-methylbenzo[d]oxazol-2(3H)-one

Guidance literature:: With nickel(II) chloride2-methoxyethyl ether; 1,4-di(diphenylphosphino)-butane; 4,4'-di-tert-butyl-2,2'-bipyridine; lithium chloride; palladium dichloride; zinc; In 1-methyl-pyrrolidin-2-one; N,N-dimethyl-formamide; at 20 - 80 ℃; for 24h; Inert atmosphere;
DOI:10.1021/jacs.9b05461