Methyl 4-[(1R)-1-azidoethyl]benzoate

Base Information

Chemical Name:Methyl 4-[(1R)-1-azidoethyl]benzoate
CAS No.:885105-34-0
Molecular Formula:C10H11N3O2
Molecular Weight:205.216
Hs Code.:
DSSTox Substance ID:DTXSID80582970
Wikidata:Q82474482

Synonyms:Methyl 4-[(1R)-1-azidoethyl]benzoate;885105-34-0;SCHEMBL13614285;DTXSID80582970;PNYJDKRGKXPKRX-SSDOTTSWSA-N;(R)-methyl 4-(1-azidoethyl)benzoate

Suppliers and Price of Methyl 4-[(1R)-1-azidoethyl]benzoate

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 Methyl 4-[(1R)-1-azidoethyl]benzoate

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:205.085126602
Heavy Atom Count:15
Complexity:266

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Methyl 4-[(1R)-1-azidoethyl]benzoate

There total 2 articles about Methyl 4-[(1R)-1-azidoethyl]benzoate 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:

: 79322-76-2,84851-56-9,129446-47-5,102681-71-0
methyl 4-[(1S)-1-hydroxyethyl]benzoate

: 885105-34-0
(R)-methyl 4-(1-azidoethyl)benzoate

Guidance literature:: methyl 4-[(1S)-1-hydroxyethyl]benzoate; With diphenylphosphoranyl azide; In toluene; at -10 ℃; for 0.0833333h;

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In toluene; at 20 ℃;
DOI:10.1021/jm061224g

Reference yield:

: 3609-53-8
methyl 4-acetylbenzoate

: 885105-34-0
(R)-methyl 4-(1-azidoethyl)benzoate

Guidance literature:: Multi-step reaction with 2 steps

1.1: BH₃*SMe₂; (R)-2-methyl-CBS-oxazaborolidine / toluene; tetrahydrofuran / 0.5 h / -10 °C

2.1: diphenylphosphoryl azide / toluene / 0.08 h / -10 °C

2.2: DBU / toluene / 20 °C

With dimethylsulfide borane complex; diphenylphosphoranyl azide; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; In tetrahydrofuran; toluene;
DOI:10.1021/jm061224g