1,3-Bis(benzyloxy)propan-2-one

Base Information

• Chemical Name: 1,3-Bis(benzyloxy)propan-2-one
• CAS No.: 77356-14-0
• Molecular Formula: C17H18O3
• Molecular Weight: 270.328
• European Community (EC) Number: 870-948-5
• DSSTox Substance ID: DTXSID00464486
• Nikkaji Number: J982.032I
• Wikidata: Q82289815
• Mol file: 77356-14-0.mol

Synonyms:1,3-BIS(BENZYLOXY)PROPAN-2-ONE;77356-14-0;1,3-bis(phenylmethoxy)propan-2-one;1,3-dibenzyloxypropanone;1,3-dibenzyloxy-2-propanone;C17H18O3;1,3-bis(benzyloxy)acetone;2-Propanone, 1,3-bis(phenylmethoxy)-;SCHEMBL476827;DTXSID00464486;UDANXEQSQZYNRE-UHFFFAOYSA-N;1,3-bis(benzyloxy)-propan-2-one;CDA35614;1,3-bis[(benzyl)oxy]-2-propanone;MFCD17926566;2-propanone,1,3-bis(phenylmethoxy)-;AT10632;1,3-Bis[(phenylmethyl)oxy]-2-propanone;AS-81899;CS-0149859;EN300-257938

Chemical Property of 1,3-Bis(benzyloxy)propan-2-one

Chemical Property:

• Melting Point: 40℃
• Refractive Index: 1.5483 (589.3 nm)
• Boiling Point: 208-212 °C(Press: 0.04 Torr)
• PSA: 35.53000
• Density: 1.115±0.06 g/cm3(Predicted)
• LogP: 2.98910
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 270.125594432
• Heavy Atom Count: 20
• Complexity: 239

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COCC(=O)COCC2=CC=CC=C2

Technology Process of 1,3-Bis(benzyloxy)propan-2-one

There total 9 articles about 1,3-Bis(benzyloxy)propan-2-one 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: 100.0%

dibenzyl glycerol (6972-79-8) → 1,3-dibenzyloxy-2-propanone (77356-14-0)

Guidance literature:

With sulfur trioxide pyridine complex; dimethyl sulfoxide; In dichloromethane; at 0 - 20 ℃; for 2h;

Reference yield: 96.0%

2-methylenepropane-1,3-bisbenzyl ether (27441-79-8) → 1,3-dibenzyloxy-2-propanone (77356-14-0)

Guidance literature:

2-methylenepropane-1,3-bisbenzyl ether; With ozone; In dichloromethane; at -60 ℃; for 0.583333h;

With triphenylphosphine; In dichloromethane; Further stages.;

DOI:10.1039/b111097g

Reference yield: 94.3%

epichlorohydrin (106-89-8,24969-06-0,13403-37-7) + benzyl alcohol (100-51-6,185532-71-2) → 1,3-dibenzyloxy-2-propanone (77356-14-0)

Guidance literature:

epichlorohydrin; benzyl alcohol; With sodium hydroxide; In water; at 20 - 35 ℃;

With phosphorus pentoxide; dimethyl sulfoxide; triethylamine; In dichloromethane; at 20 ℃; for 2h; Solvent; Inert atmosphere; Cooling with ice;

upstream raw materials:

dibenzyl glycerol

1,3-Dichloroacetone

sodium phenyl-methanolate

2-methylenepropane-1,3-bisbenzyl ether

Downstream raw materials:

3-benzyloxypropanone

1,2-diphenyl-1,2-ethanediol

3-benzyloxymethyl-2-phenyloxetan-3-ol

cis-7-phenyl-2,4,6-trioxabicyclo<3.2.0>heptan-3-one

Refernces

• 1、 -. "N-[2-(2-AMINO-6,6-DISUBSTITUTED-4, 4A, 5, 6-TETRAHYDROPYRANO [3,4-D][1,3] THIAZIN-8A (8H)-YL) -1, 3-THIAZOL-4-YL] AMIDES". Page/Page column 87; 88; 89. . Retrieved 2017/04/11.
• 2、 Lauber, Markus B.,Stahl, Shannon S.. "Efficient aerobic oxidation of secondary alcohols at ambient temperature with an ABNO/NOx catalyst system". . p. 2612 - 2616. Retrieved 2013/11/19.