(3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-3-carbonitrile

Base Information

Chemical Name:(3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-3-carbonitrile
CAS No.:78759-37-2
Molecular Formula:C14H16N2O
Molecular Weight:228.294
Hs Code.:
DSSTox Substance ID:DTXSID80508731
Wikidata:Q82365875

Synonyms:78759-37-2;DTXSID80508731;(3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-3-carbonitrile

Suppliers and Price of (3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-3-carbonitrile

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of (3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-3-carbonitrile

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:228.126263138
Heavy Atom Count:17
Complexity:354

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)N1C(C(C1=O)C#N)C2=CC=CC=C2
Isomeric SMILES:CC(C)(C)N1[C@H]([C@@H](C1=O)C#N)C2=CC=CC=C2

Technology Process of (3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-3-carbonitrile

There total 6 articles about (3R,4R)-1-tert-Butyl-2-oxo-4-phenylazetidine-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:

: 6852-58-0
N-benzylidene tert-butylamine

: 78759-37-2
trans-N-tert-butyl-3-cyano-4-phenyl-2-azetidinone

Guidance literature:: Multi-step reaction with 2 steps

1: Heating

2: Zn, AcOH

With acetic acid; zinc;
DOI:10.1021/ja00406a065

Reference yield:

: 78759-38-3
1-tert-Butyl-3-chloro-2-oxo-4-phenyl-azetidine-3-carbonitrile

: 78759-37-2
trans-N-tert-butyl-3-cyano-4-phenyl-2-azetidinone

: 78759-36-1
cis-N-tert-butyl-3-cyano-4-phenyl-2-azetidinone

Guidance literature:: With acetic acid; zinc;
DOI:10.1021/ja00406a065

Reference yield:

: 78759-35-0
trans-5-cyano-4-nitro-3-phenyl-N-tert-butylisoxazolidine

: 78759-37-2
trans-N-tert-butyl-3-cyano-4-phenyl-2-azetidinone

Guidance literature:: Multi-step reaction with 3 steps

1: Potassium tert-Butoxide / dimethylsulfoxide / 18 h / Ambient temperature

2: 81 percent / benzene / 0.08 h / Heating

3: Zn/CH₃COOH / diethyl ether / 2 h / 0 °C

With potassium tert-butylate; acetic acid; zinc; In diethyl ether; dimethyl sulfoxide; benzene;
DOI:10.1021/jo00176a013