4-Benzyloxyphenylacetone

Base Information

• Chemical Name: 4-Benzyloxyphenylacetone
• CAS No.: 5586-92-5
• Molecular Formula: C16H16O2
• Molecular Weight: 240.302
• Hs Code.: 2914509090
• European Community (EC) Number: 611-326-3
• DSSTox Substance ID: DTXSID70340066
• Wikidata: Q82109514
• Mol file: 5586-92-5.mol

Synonyms:4-Benzyloxyphenylacetone;5586-92-5;1-[4-(Benzyloxy)phenyl]acetone;1-(4-(Benzyloxy)phenyl)propan-2-one;1-(4-phenylmethoxyphenyl)propan-2-one;1-(4-Benzyloxyphenyl)propan-2-one;SCHEMBL68570;DTXSID70340066;1-[4-(Benzyloxy)phenyl]acetone #;MFCD02683827;1-(4-benzyloxyphenyl) propan-2-one;AKOS016845846;A8089

Chemical Property of 4-Benzyloxyphenylacetone

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 59-60 °C
• Refractive Index: 1.563
• Boiling Point: 372.521°C at 760 mmHg
• Flash Point: 162.208°C
• PSA: 26.30000
• Density: 1.089g/cm³
• LogP: 3.39710
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 240.115029749
• Heavy Atom Count: 18
• Complexity: 248

Purity/Quality:

99%min. ^*data from raw suppliers

4-Benzyloxyphenylacetone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)CC1=CC=C(C=C1)OCC2=CC=CC=C2

Technology Process of 4-Benzyloxyphenylacetone

There total 9 articles about 4-Benzyloxyphenylacetone 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: 96.0%

C18H18O4 → 1-(4-benzyloxyphenyl)propan-2-one (5586-92-5)

Guidance literature:

With dimethyl sulfoxide; sodium chloride; In water; at 150 ℃;

DOI:10.1016/j.bmcl.2009.09.087

Reference yield: 27.0%

2-[4-(benzyloxy)benzyl]acetic acid (6547-53-1) + acetic anhydride (108-24-7) → 1-(4-benzyloxyphenyl)propan-2-one (5586-92-5)

Guidance literature:

With pyridine; for 6h; Heating;

DOI:10.1021/jm070030d

Reference yield:

4-methoxyphenylacetone (770-39-8) → 1-(4-benzyloxyphenyl)propan-2-one (5586-92-5)

Guidance literature:

With potassium carbonate; In acetone; at 20 ℃;

DOI:10.1016/j.bmc.2015.01.024

upstream raw materials:

2-<4-(phenylmethoxy)phenyl>acetic acid ethyl ester

methyllithium

1-benzyloxy-4-(2-nitropropyl)benzene

2-[4-(benzyloxy)benzyl]acetic acid

Downstream raw materials:

4-methoxyphenylacetone

1-(4-benzyloxyphenyl)-2-benzylaminopropane

(R)-(-)-1-(4-benzyloxyphenyl)-2-benzylaminopropane

(S)-(+)-1-(4-benzyloxyphenyl)-2-benzylaminopropane