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Phenylacetaldehyde 1,3-propanediyl acetal, also known as 1,3-Dioxolane, is an organic compound with the chemical formula C11H14O2. It is a colorless liquid that is soluble in water and has a molecular weight of 178.23 g/mol. This acetal is formed by the reaction of phenylacetaldehyde with 1,3-propanediol, resulting in a cyclic structure that protects the aldehyde group. It is commonly used as a synthetic intermediate in the production of various chemicals, fragrances, and pharmaceuticals due to its ability to stabilize aldehydes and prevent unwanted side reactions. The compound is also known for its pleasant, floral odor, making it a valuable component in the perfume industry.

5468-00-8

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5468-00-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5468-00-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,6 and 8 respectively; the second part has 2 digits, 0 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 5468-00:
(6*5)+(5*4)+(4*6)+(3*8)+(2*0)+(1*0)=98
98 % 10 = 8
So 5468-00-8 is a valid CAS Registry Number.
InChI:InChI=1/C11H14O2/c1-2-5-10(6-3-1)9-11-12-7-4-8-13-11/h1-3,5-6,11H,4,7-9H2

5468-00-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-benzyl-1,3-dioxane

1.2 Other means of identification

Product number -
Other names Phenyl acetaldehyde cyclic acetal with trimethylene glycol

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:5468-00-8 SDS

5468-00-8Relevant academic research and scientific papers

Catalysis of Pd(II)-catalyzed acetalization of alkenes with diols

Hosokawa,Ataka,Murahashi

, p. 166 - 169 (1990)

Alkenes bearing electron-withdrawing substituents are catalytically acetalized with 1,3-propanediol only by the use of PdCl2(MeCN)2 catalyst under O2 atmosphere. When a combination of BiCl3 and LiCl is used as co-catalyst, the acetalization proceeds effectively. These results indicate that a hydroperoxopalladium(II) species is most likely an active catalyst in the present reaction.

Aromatic Monomers by in Situ Conversion of Reactive Intermediates in the Acid-Catalyzed Depolymerization of Lignin

Deuss, Peter J.,Scott, Martin,Tran, Fanny,Westwood, Nicholas J.,De Vries, Johannes G.,Barta, Katalin

supporting information, p. 7456 - 7467 (2015/06/30)

Conversion of lignin into well-defined aromatic chemicals is a highly attractive goal but is often hampered by recondensation of the formed fragments, especially in acidolysis. Here, we describe new strategies that markedly suppress such undesired pathways to result in diverse aromatic compounds previously not systematically targeted from lignin. Model studies established that a catalytic amount of triflic acid is very effective in cleaving the β-O-4 linkage, most abundant in lignin. An aldehyde product was identified as the main cause of side reactions under cleavage conditions. Capturing this unstable compound by reaction with diols and by in situ catalytic hydrogenation or decarbonylation lead to three distinct groups of aromatic compounds in high yields acetals, ethanol and ethyl aromatics, and methyl aromatics. Notably, the same product groups were obtained when these approaches were successfully extended to lignin. In addition, the formation of higher molecular weight side products was markedly suppressed, indicating that the aldehyde intermediates play a significant role in these processes. The described strategy has the potential to be generally applicable for the production of interesting aromatic compounds from lignin.

Photoinduced Molecular Transformations. Part 113. One-step Transformations of Cyclic Ethers into ω-Iodoalkyl Formates and of Aldehyde Cyclic Acetals into Monoesters of α,ω-Alkanediols by Iodoxyl Radical

Suginome, Hiroshi,Wang, Jian Bo

, p. 2825 - 2829 (2007/10/02)

The reaction of cyclic ethers with iodoxyl radical and iodine oxide gives the corresponding ω-iodoalkyl formates in one step; tetrahydrofuran can be transformed into ω-iodoalkyl formate in 31percent yield.Aldehyde cyclic acetals under conditions similar to the reaction of cyclic ethers lead to monoesters of α,ω-alkanediols in one step; cyclohexanecarboxaldehyde ethylene acetal gives 2-hydroxy cyclohexanecarboxylate in 60percent yield.The pathways leading to ω-iodoalkyl formatesand monoesters of α,ω-alkanediols are discussed based on the results of 18O-labelling studies with (18)OI and I2(18)O.

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