3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole

Base Information

Chemical Name:3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole
CAS No.:90328-91-9
Molecular Formula:C11H11NO2
Molecular Weight:189.21100
Hs Code.:
DSSTox Substance ID:DTXSID70506488
Nikkaji Number:J1.100.552G

Synonyms:3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole;90328-91-9;DTXSID70506488

Suppliers and Price of 3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
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Total 0 raw suppliers

Chemical Property of 3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole

Chemical Property:

Melting Point:106 - 107 °C
Boiling Point:304.4±52.0 °C(Predicted)
PSA：30.82000
Density:1.33±0.1 g/cm3(Predicted)
LogP:1.21910
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:189.078978594
Heavy Atom Count:14
Complexity:246

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1COC2C1C(=NO2)C3=CC=CC=C3

Technology Process of 3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole

There total 5 articles about 3-Phenyl-3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole 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: 85.0%

: 1191-99-7,75454-45-4
2,3-dihydro-2H-furan

: 622-42-4
1-nitro-1-phenylmethane

: 18798-87-3,74069-17-3,90328-91-9
(3aS,6aS)-3-Phenyl-3a,4,5,6a-tetrahydro-furo[3,2-d]isoxazole

Guidance literature:: With sodium methylate; acetyl chloride; In N,N-dimethyl acetamide; for 16h; Ambient temperature;
DOI:10.1248/cpb.28.3296

Reference yield:

: 59728-62-0
3-phenyl-(3ar,6ac)-3a,6a-dihydro-furo[3,2-d]isoxazole

: 90328-91-9
3-phenyl-3a,4,5,6a-tetrahydrofuro<3,2-d>isoxazole

Guidance literature:: With hydrogen; palladium on activated charcoal; In acetic acid; ethyl acetate;
DOI:10.1021/jo00883a002

Reference yield:

: 698-16-8
benzohydroximoyl chloride

: 90328-91-9
3-phenyl-3a,4,5,6a-tetrahydrofuro<3,2-d>isoxazole

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N

2: H₂ / Pd-C / ethyl acetate; acetic acid

With hydrogen; triethylamine; palladium on activated charcoal; In acetic acid; ethyl acetate;
DOI:10.1021/jo00883a002