4-Amino-5-benzoylisoxazole-3-carbonitrile

Base Information

Chemical Name:4-Amino-5-benzoylisoxazole-3-carbonitrile
CAS No.:76390-68-6
Molecular Formula:C11H7N3O2
Molecular Weight:213.195
Hs Code.:
DSSTox Substance ID:DTXSID50415423
Nikkaji Number:J835.788I
Wikidata:Q82224348

Synonyms:4-Amino-5-benzoylisoxazole-3-carbonitrile;76390-68-6;ST091544;3-Isoxazolecarbonitrile, 4-amino-5-benzoyl-;DTXSID50415423;GKHVYZGKFJOVHL-UHFFFAOYSA-N;STK783314;AKOS005619968;4-amino-5-(phenylcarbonyl)-1,2-oxazole-3-carbonitrile

Suppliers and Price of 4-Amino-5-benzoylisoxazole-3-carbonitrile

Supply Marketing:

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

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Chemical Property of 4-Amino-5-benzoylisoxazole-3-carbonitrile

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:213.053826475
Heavy Atom Count:16
Complexity:316

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)C2=C(C(=NO2)C#N)N

Technology Process of 4-Amino-5-benzoylisoxazole-3-carbonitrile

There total 3 articles about 4-Amino-5-benzoylisoxazole-3-carbonitrile 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: 40.0%

: 57967-31-4
Cyan(phenacyloxyimino)acetamid

: 76390-68-6
4-Amino-5-benzoylisoxazol-3-carbonitril

: 76390-64-2
4-amino-5-benzoylisoxazole-3-carboxamide

Guidance literature:: With lithium hydroxide;

Reference yield: 30.0%

: 76390-55-1
(Phenacyloxyimino)malonsaeuredinitril

: 76390-68-6
4-Amino-5-benzoylisoxazol-3-carbonitril

Guidance literature:: With triethylamine; In ethanol; for 0.5h;

Reference yield:

: 70-11-1
α-bromoacetophenone

: 76390-68-6
4-Amino-5-benzoylisoxazol-3-carbonitril

Guidance literature:: Multi-step reaction with 2 steps

1: 82 percent / dimethylformamide / 0.5 h / Ambient temperature

2: 30 percent / Et₃N / ethanol / 0.5 h

With triethylamine; In ethanol; N,N-dimethyl-formamide;