(alphaS,betaR)-alpha-Azido-beta-(1-methylethyl)benzenepropanoic acid

Base Information

Chemical Name:(alphaS,betaR)-alpha-Azido-beta-(1-methylethyl)benzenepropanoic acid
CAS No.:175853-66-4
Molecular Formula:C₁₂H₁₅N₃O₂
Molecular Weight:233.27
Hs Code.:
DSSTox Substance ID:DTXSID901207422
Nikkaji Number:J712.146F

Synonyms:DTXSID901207422;175853-66-4

Suppliers and Price of (alphaS,betaR)-alpha-Azido-beta-(1-methylethyl)benzenepropanoic acid

Supply Marketing:

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

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Chemical Property of (alphaS,betaR)-alpha-Azido-beta-(1-methylethyl)benzenepropanoic acid

Chemical Property:

XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:233.116426730
Heavy Atom Count:17
Complexity:305

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)C(C1=CC=CC=C1)C(C(=O)O)N=[N+]=[N-]
Isomeric SMILES:CC(C)[C@H](C1=CC=CC=C1)[C@@H](C(=O)O)N=[N+]=[N-]

Technology Process of (alphaS,betaR)-alpha-Azido-beta-(1-methylethyl)benzenepropanoic acid

There total 10 articles about (alphaS,betaR)-alpha-Azido-beta-(1-methylethyl)benzenepropanoic acid 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: 90.0%

: 175853-65-3
(R)-3-((2S,3R)-2-Azido-4-methyl-3-phenyl-pentanoyl)-4-phenyl-oxazolidin-2-one

: 175853-66-4
(2S,3R)-2-azido-3-phenylisohexanoic acid

Guidance literature:: With lithium hydroxide; dihydrogen peroxide; at 0 ℃;
DOI:10.1016/0040-4039(96)00091-3

Reference yield:

: 175853-64-2
(R)-3-((2R,3R)-2-Bromo-4-methyl-3-phenyl-pentanoyl)-4-phenyl-oxazolidin-2-one

: 175853-66-4
(2S,3R)-2-azido-3-phenylisohexanoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / tetramethylguanidine azide / acetonitrile / 24 h / Ambient temperature

2: 72 percent / hydrogen peroxide, lithium hydroxide monohydrate / tetrahydrofuran; H₂O / 3 h

With lithium hydroxide; dihydrogen peroxide; tetramethylguanidinum azide; In tetrahydrofuran; water; acetonitrile;
DOI:10.1016/S0040-4020(97)10127-2

Reference yield:

: 176018-92-1
(R)-3-((R)-4-Methyl-3-phenyl-pentanoyl)-4-phenyl-oxazolidin-2-one

: 175853-66-4
(2S,3R)-2-azido-3-phenylisohexanoic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) diisopropylethylamine, dibutylboron triflate, 2.) N-bromosuccinimide / 1.) CH₂Cl₂, 2.) CH₂Cl₂

2: 80 percent / tetramethylguanidine azide / acetonitrile / 24 h / Ambient temperature

3: 72 percent / hydrogen peroxide, lithium hydroxide monohydrate / tetrahydrofuran; H₂O / 3 h

With lithium hydroxide; N-Bromosuccinimide; di-n-butylboryl trifluoromethanesulfonate; dihydrogen peroxide; N-ethyl-N,N-diisopropylamine; tetramethylguanidinum azide; In tetrahydrofuran; water; acetonitrile;
DOI:10.1016/S0040-4020(97)10127-2