Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate

Base Information

Chemical Name:Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate
CAS No.:220801-67-2
Molecular Formula:C₁₇H₁₇BrO₃
Molecular Weight:349.224
Hs Code.:
DSSTox Substance ID:DTXSID701216681

Synonyms:DTXSID701216681;Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate;220801-67-2

Suppliers and Price of Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate

Supply Marketing:

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

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Chemical Property of Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:348.03611
Heavy Atom Count:21
Complexity:328

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)Br)CC(=O)OC
Isomeric SMILES:C[C@@H](C1=CC=CC=C1)OC2=C(C=C(C=C2)Br)CC(=O)OC

Technology Process of Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate

There total 2 articles about Methyl 5-bromo-2-[(1S)-1-phenylethoxy]benzeneacetate 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:

: 614-75-5
2-Hydroxyphenylacetic acid

: 220801-67-2
(S)-methyl <5-bromo-2-(1-phenylethoxy)phenyl>acetate

Guidance literature:: Multi-step reaction with 2 steps

1: tetrabutylammonium tribromide / 18 h / Ambient temperature

2: PPh₃, DEAD / toluene / Ambient temperature

With tetra-N-butylammonium tribromide; triphenylphosphine; diethylazodicarboxylate; In toluene;
DOI:10.1021/jm980540v

Reference yield:

: 1517-69-7
(R)-1-phenylethanol

: 220801-66-1
5-bromo-2-hydroxylphenylacetic acid methyl ester

: 205318-13-4
(R)-methyl <5-bromo-2-(1-phenylethoxy)phenyl>acetate

: 220801-67-2
(S)-methyl <5-bromo-2-(1-phenylethoxy)phenyl>acetate

Guidance literature:: With triphenylphosphine; diethylazodicarboxylate; In toluene; Title compound not separated from byproducts; Ambient temperature;
DOI:10.1021/jm980540v

Reference yield:

: 220801-67-2
(S)-methyl <5-bromo-2-(1-phenylethoxy)phenyl>acetate

: [5-((E)-2-Diethylcarbamoyl-1-methyl-vinyl)-2-((S)-1-phenyl-ethoxy)-phenyl]-acetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N, tri-o-tolylphosphine, palladium acetate / 5 h / 100 °C

2: 1N aq. NaOH / methanol / 2 h / Ambient temperature

With sodium hydroxide; palladium diacetate; triethylamine; tris-(o-tolyl)phosphine; In methanol;
DOI:10.1021/jm980540v