1,3-Dioxolane-2-methanol, 2-phenyl-

Base Information

• Chemical Name: 1,3-Dioxolane-2-methanol, 2-phenyl-
• CAS No.: 33868-51-8
• Molecular Formula: C10H12O3
• Molecular Weight: 180.203
• European Community (EC) Number: 841-990-1
• DSSTox Substance ID: DTXSID001299494
• Mol file: 33868-51-8.mol

Synonyms:33868-51-8;(2-phenyl-1,3-dioxolan-2-yl)methanol;1,3-Dioxolane-2-methanol, 2-phenyl-;SCHEMBL1876064;YUUFLSYPPSEURX-UHFFFAOYSA-N;DTXSID001299494;2-Phenyl-1,3-dioxolane-2-methanol;(2-phenyl-[1,3]dioxolan-2-yl)methanol;FT-0737581;EN300-7442110

Chemical Property of 1,3-Dioxolane-2-methanol, 2-phenyl-

Chemical Property:

• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 180.078644241
• Heavy Atom Count: 13
• Complexity: 158

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COC(O1)(CO)C2=CC=CC=C2

Technology Process of 1,3-Dioxolane-2-methanol, 2-phenyl-

There total 6 articles about 1,3-Dioxolane-2-methanol, 2-phenyl- 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: 98.0%

ethylene glycol (107-21-1) + 1-phenyl-2-hydroxyethanone (582-24-1) → 2-hydroxymethyl-2-phenyl-1,3-dioxolane (33868-51-8)

Guidance literature:

toluene-4-sulfonic acid; In benzene; for 24h; Heating / reflux;

Reference yield: 45.0%

tert-butyldimethyl-(2-phenyl-[1,3]dioxolan-2-yl-methoxy)silane (1264942-63-3) → 2-hydroxymethyl-2-phenyl-1,3-dioxolane (33868-51-8)

Guidance literature:

With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 20 ℃; for 12h;

Reference yield:

2-(tert-butyldimethylsilanyloxy)-1-phenylethan-1-one (103548-04-5) → 2-hydroxymethyl-2-phenyl-1,3-dioxolane (33868-51-8)

Guidance literature:

Multi-step reaction with 2 steps

1: toluene-4-sulfonic acid / benzene / 5 h / Reflux

2: tetrabutyl ammonium fluoride / tetrahydrofuran / 12 h / 20 °C

With tetrabutyl ammonium fluoride; toluene-4-sulfonic acid; In tetrahydrofuran; benzene;

upstream raw materials:

ethylene glycol

1-phenyl-2-hydroxyethanone

2-(tert-butyldimethylsilanyloxy)-1-phenylethan-1-one

tert-butyldimethyl-(2-phenyl-[1,3]dioxolan-2-yl-methoxy)silane

Downstream raw materials:

2-(3,5-bis(trifluoromethyl)benzyloxymethyl)-2-phenyl-[1,3]dioxolane

methyl 2-oxo-2-phenylacetate

1-phenyl-2-hydroxyethanone

Benzoylformic acid