4,5-Dihydro-naphtho[1,2-c]isoxazole

Base Information

Chemical Name:4,5-Dihydro-naphtho[1,2-c]isoxazole
CAS No.:66417-91-2
Molecular Formula:C11H9NO
Molecular Weight:171.19500
Hs Code.:2934999090
DSSTox Substance ID:DTXSID80497813
Wikidata:Q82347577
Mol file:66417-91-2.mol

Synonyms:4,5-Dihydro-naphtho[1,2-c]isoxazole;66417-91-2;4,5-dihydrobenzo[g][2,1]benzoxazole;SCHEMBL4089706;DTXSID80497813;AKOS006325438;4,5-Dihydronaphtho[1,2-c][1,2]oxazole

Suppliers and Price of 4,5-Dihydro-naphtho[1,2-c]isoxazole

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

Crysdot
4,5-Dihydro-naphtho[1,2-c]isoxazole 95+%
1g
$ 1211.00

American Custom Chemicals Corporation
4,5-DIHYDRO-NAPHTHO(1,2-C)ISOXAZOLE 95.00%
5MG
$ 502.66

Total 5 raw suppliers

Chemical Property of 4,5-Dihydro-naphtho[1,2-c]isoxazole

Chemical Property:

Boiling Point:114-117 °C(Press: 0.3-0.4 Torr)
PKA:-2.41±0.20(Predicted)
PSA：26.03000
Density:1.178 g/cm3
LogP:2.44020
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:171.068413911
Heavy Atom Count:13
Complexity:195

Purity/Quality:

99% ^*data from raw suppliers

4,5-Dihydro-naphtho[1,2-c]isoxazole 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC2=CON=C2C3=CC=CC=C31

Technology Process of 4,5-Dihydro-naphtho[1,2-c]isoxazole

There total 6 articles about 4,5-Dihydro-naphtho[1,2-c]isoxazole 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: 72.0%

: 1-azido-3,4-dihydro-naphthalene-2-carbaldehyde

: 66417-91-2
4,5-Dihydronaphth<1,2-c>isoxazol

Guidance literature:: In dichloromethane; for 24h; Heating;

Reference yield:

: 40685-04-9
1,2,3,4-tetrahydro-2-(hydroxymethylene)naphthalen-1-one

: 66417-91-2
4,5-Dihydronaphth<1,2-c>isoxazol

: 27439-89-0
4,5-dihydro-naphtho[2,1-d]isoxazole

Guidance literature:: With hydroxylamine hydrochloride; In acetic acid; at 80 ℃; for 1h;
DOI:10.1021/jacs.0c13273

Reference yield:

: 3262-03-1
1-chloro-2-formyl-3,4-dihydronaphthalene

: 66417-91-2
4,5-Dihydronaphth<1,2-c>isoxazol

Guidance literature:: Multi-step reaction with 2 steps

1: 87 percent / NaN₃ / dimethylsulfoxide / 5 - 25 °C

2: 72 percent / CH₂Cl₂ / 24 h / Heating

With sodium azide; In dichloromethane; dimethyl sulfoxide; 1: Substitution / 2: Cyclization;