1-(5-Hydroxy-2-phenyl-1,3-dioxan-4-yl)ethane-1,2-diol

Base Information

• Chemical Name: 1-(5-Hydroxy-2-phenyl-1,3-dioxan-4-yl)ethane-1,2-diol
• CAS No.: 70831-50-4
• Molecular Formula: C12H16O5
• Molecular Weight: 240.256
• Hs Code.: 2932990090
• DSSTox Substance ID: DTXSID50398146
• Mol file: 70831-50-4.mol

Synonyms:70831-50-4;1-(5-hydroxy-2-phenyl-1,3-dioxan-4-yl)ethane-1,2-diol;AC1N0XGH;HMS1548L03;TimTec1_005173;Oprea1_126623;SCHEMBL4736780;DTXSID50398146

Chemical Property of 1-(5-Hydroxy-2-phenyl-1,3-dioxan-4-yl)ethane-1,2-diol

Chemical Property:

• PSA: 79.15000
• LogP: -0.18530
• XLogP3: 0
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 240.09977361
• Heavy Atom Count: 17
• Complexity: 229

Purity/Quality:

99% ^*data from raw suppliers

1,3-O-Benzylidene-D-arabitol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(OC(O1)C2=CC=CC=C2)C(CO)O)O

Technology Process of 1-(5-Hydroxy-2-phenyl-1,3-dioxan-4-yl)ethane-1,2-diol

There total 2 articles about 1-(5-Hydroxy-2-phenyl-1,3-dioxan-4-yl)ethane-1,2-diol 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: 82.0%

D-Arabitol (488-82-4) + benzaldehyde dimethyl acetal (1125-88-8) → 1,3-o-benzylidene-D-arabinitol (70831-50-4,53131-06-9)

Guidance literature:

With toluene-4-sulfonic acid; In N,N-dimethyl-formamide; at 40 ℃; for 8h;

Reference yield: 62.4%

D-Arabitol (488-82-4) + benzaldehyde (100-52-7) → 1,3-o-benzylidene-D-arabinitol (70831-50-4,53131-06-9)

Guidance literature:

D-Arabitol; benzaldehyde; With hydrogenchloride;

With ammonia; In water; toluene; for 1h;

Reference yield: 80.8%

1,3-o-benzylidene-D-arabinitol (70831-50-4,53131-06-9) + p-toluenesulfonyl chloride (98-59-9) → 1,3-O-benzylidene-5-O-toluenesulfonyl-D-arabitol (935527-48-3)

Guidance literature:

With di(n-butyl)tin oxide; triethylamine; In dichloromethane; at 20 ℃; for 20h;

upstream raw materials:

D-Arabitol

benzaldehyde

benzaldehyde dimethyl acetal

Downstream raw materials:

1,3-O-benzylidene-5-O-toluenesulfonyl-D-arabitol