5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one

Base Information

Chemical Name:5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one
CAS No.:60986-80-3
Molecular Formula:C19H14N2O2
Molecular Weight:302.33
Hs Code.:2934999090
ChEMBL ID:CHEMBL595840
DSSTox Substance ID:DTXSID10401226
Pharos Ligand ID:AF8BV9X1WQJW
Wikidata:Q27083761
Mol file:60986-80-3.mol

Synonyms:60986-80-3;5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one;5-methyl-3,6-diphenyl-[1,2]oxazolo[4,5-c]pyridin-4-one;CHEMBL595840;3,6-DIPHENYL-5-METHYLISOXAZOLO(4,5-C)PYRIDIN-4(5H)-ONE;MLS002153017;GTPL6218;SCHEMBL3663640;cid_4250909;DTXSID10401226;LCNDUGHNYMJGIW-UHFFFAOYSA-N;5-methyl-3,6-diphenyl-isoxazolo[4,5-c]pyridine-4(5H)-one;HMS2206G07;HMS3358C19;BDBM50305859;AKOS024323421;SMR001229079;FT-0714059;Q27083761;5-methyl-3,6-diphenyl-isoxazolo[4,5-c]pyridin-4(5H)-one;5-methyl-3,6-di(phenyl)-[1,2]oxazolo[4,5-c]pyridin-4-one

Suppliers and Price of 5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one

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

American Custom Chemicals Corporation
5-METHYL-3,6-DIPHENYL-4H,5H-[1,2]OXAZOLO[4,5-C]PYRIDIN-4-ONE 95.00%
1G
$ 621.69

Total 4 raw suppliers

Chemical Property of 5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one

Chemical Property:

Vapor Pressure:6.67E-13mmHg at 25°C
Refractive Index:1.632
Boiling Point:567.7°C at 760 mmHg
PKA:-4.44±0.40(Predicted)
Flash Point:297.1°C
PSA：48.03000
Density:1.256g/cm³
LogP:3.86050
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:302.105527694
Heavy Atom Count:23
Complexity:478

Purity/Quality:

99% ^*data from raw suppliers

5-METHYL-3,6-DIPHENYL-4H,5H-[1,2]OXAZOLO[4,5-C]PYRIDIN-4-ONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=CC2=C(C1=O)C(=NO2)C3=CC=CC=C3)C4=CC=CC=C4

Technology Process of 5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one

There total 4 articles about 5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one 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:

: 60986-74-5
5-(2-oxo-2-phenyl-ethyl)-3-phenyl-isoxazole-4-carboxylic acid methylamide

: 60986-80-3
5-methyl-3,6-diphenyl-isoxazolo[4,5-c]pyridine-4(5H)-one

Guidance literature:: With sulfuric acid;

Reference yield:

: 5-(2-amino-2-phenylethenyl)-N-methyl-3-phenyl-isoxazole-4-carboxamide

: 60986-80-3
5-methyl-3,6-diphenyl-isoxazolo[4,5-c]pyridine-4(5H)-one

Guidance literature:: With hydrogenchloride; In water; acetone;

Reference yield:

: 60986-88-1
N,5-dimethyl-3-phenyl-isoxazole-4-carboxamide

: 60986-80-3
5-methyl-3,6-diphenyl-isoxazolo[4,5-c]pyridine-4(5H)-one

Guidance literature:: Multi-step reaction with 3 steps

1: n-butyllithium; ammonium chloride; benzaldehyde / tetrahydrofuran; hexane; Petroleum ether

2: acetic acid / water

3: sulfuric acid

With n-butyllithium; sulfuric acid; ammonium chloride; benzaldehyde; acetic acid; In tetrahydrofuran; hexane; water; Petroleum ether;