Benzenemethanol, 2-(acetyloxy)-alpha-ethenyl-, 1-acetate

Base Information

Chemical Name:Benzenemethanol, 2-(acetyloxy)-alpha-ethenyl-, 1-acetate
CAS No.:274927-62-7
Molecular Formula:C13H14O4
Molecular Weight:234.252
Hs Code.:
DSSTox Substance ID:DTXSID301219540
ChEMBL ID:CHEMBL360018

Synonyms:CHEMBL360018;DTXSID301219540;(+/-)-1-acetoxy-1-(2-acetoxyphenyl)-2-propene;Benzenemethanol, 2-(acetyloxy)-alpha-ethenyl-, 1-acetate;274927-62-7

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

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Chemical Property of Benzenemethanol, 2-(acetyloxy)-alpha-ethenyl-, 1-acetate

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:234.08920892
Heavy Atom Count:17
Complexity:298

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=O)OC1=CC=CC=C1C(C=C)OC(=O)C

Technology Process of Benzenemethanol, 2-(acetyloxy)-alpha-ethenyl-, 1-acetate

There total 4 articles about Benzenemethanol, 2-(acetyloxy)-alpha-ethenyl-, 1-acetate 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:

: 89-95-2
2-methyl-benzyl alcohol

: 274927-62-7
(1'R,S)-1-(2-acetoxyphenyl)-2-propene-1-acetate

Guidance literature:: Multi-step reaction with 2 steps

1: tetrahydrofuran / 3.5 h

2: pyridine

With pyridine; In tetrahydrofuran; 1: Addition / 2: Acetylation;
DOI:10.1021/jf990528r

Reference yield:

: 1-(2-((tert-butyldimethylsilyl)oxy)phenyl)prop-2-en-1-ol

: 274927-62-7
(1'R,S)-1-(2-acetoxyphenyl)-2-propene-1-acetate

Guidance literature:: Multi-step reaction with 2 steps

1: tetrabutylammonium fluoride / tetrahydrofuran / 20 °C

2: pyridine / 20 °C

With pyridine; tetrabutyl ammonium fluoride; In tetrahydrofuran;
DOI:10.1016/j.bmcl.2005.01.070

Reference yield:

: 89-95-2
2-methyl-benzyl alcohol

: 274927-62-7
(1'R,S)-1-(2-acetoxyphenyl)-2-propene-1-acetate

Guidance literature:: Multi-step reaction with 4 steps

1: imidazole; pyridine / 20 °C

2: tetrahydrofuran / 0 °C

3: tetrabutylammonium fluoride / tetrahydrofuran / 20 °C

4: pyridine / 20 °C

With pyridine; 1H-imidazole; tetrabutyl ammonium fluoride; In tetrahydrofuran; 2: Grignard reaction;
DOI:10.1016/j.bmcl.2005.01.070