2-Hydroxy-1-phenylethyl acetate

Base Information

• Chemical Name: 2-Hydroxy-1-phenylethyl acetate
• CAS No.: 10522-02-8
• Deprecated CAS: 127707-64-6
• Molecular Formula: C10H12O3
• Molecular Weight: 0.00000
• European Community (EC) Number: 247-040-7
• DSSTox Substance ID: DTXSID20884485
• Nikkaji Number: J414.443K
• Mol file: 10522-02-8.mol

Synonyms:2-Hydroxy-1-phenylethyl acetate;10522-02-8;(2-hydroxy-1-phenylethyl) acetate;1,2-Ethanediol, 1-phenyl-, 1-acetate;25496-77-9;EINECS 247-040-7;Acetic acid alpha-(hydroxymethyl)benzyl ester;2-Acetoxy-2-phenylethanol;2-Acetoxy-2-phenylathan-1-ol;SCHEMBL8467351;DTXSID20884485

Chemical Property of 2-Hydroxy-1-phenylethyl acetate

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 180.078644241
• Heavy Atom Count: 13
• Complexity: 162

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OC(CO)C1=CC=CC=C1

Technology Process of 2-Hydroxy-1-phenylethyl acetate

There total 59 articles about 2-Hydroxy-1-phenylethyl 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: 47.0%

phenylethane 1,2-diol (93-56-1) → 2-phenyl-2-hydroxyethyl acetate (127707-63-5) + 2-hydroxy-1-phenylethyl acetate (127707-64-6,10522-02-8) + 1,2-diacetoxy-1-phenyl-ethane (6270-03-7,83023-91-0)

Guidance literature:

cesium fluoride; In acetonitrile; for 8h; Ambient temperature; other catalists: tertiery amine, Lewis acids;

DOI:10.1016/S0040-4039(00)87048-3

Reference yield: 25.0%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) → phenylethane 1,2-diol (93-56-1) + 2-phenyl-2-hydroxyethyl acetate (127707-63-5) + 2-hydroxy-1-phenylethyl acetate (127707-64-6,10522-02-8) + 1,2-diacetoxy-1-phenyl-ethane (6270-03-7,83023-91-0)

Guidance literature:

With dihydrogen peroxide; ruthenium trichloride; In acetic acid; at 80 ℃;

DOI:10.1039/c39870001266

Reference yield: 14.0%

phenylethane 1,2-diol (93-56-1) + N-acetyl-1,3-oxazol-2-one (60759-49-1) → 2-phenyl-2-hydroxyethyl acetate (127707-63-5) + 2-hydroxy-1-phenylethyl acetate (127707-64-6,10522-02-8) + 1,2-diacetoxy-1-phenyl-ethane (6270-03-7,83023-91-0)

Guidance literature:

cesium fluoride; In acetonitrile; for 1h;

DOI:10.1016/S0040-4020(01)91572-8

upstream raw materials:

styrene

lead(IV) tetraacetate

styrene oxide

acetic acid

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