CORTEX ALDEHYDE 50 BENZYL ALCOHOL

Base Information

• Chemical Name: CORTEX ALDEHYDE 50 BENZYL ALCOHOL
• CAS No.: 2120-70-9
• Molecular Formula: C8H8 O2
• Molecular Weight: 136.15
• Hs Code.: 2912499000
• European Community (EC) Number: 218-329-5
• NSC Number: 49355
• DSSTox Substance ID: DTXSID1051858
• Nikkaji Number: J33.410C
• Wikidata: Q81984843
• Mol file: 2120-70-9.mol

Synonyms:Acetaldehyde,phenoxy- (6CI,7CI,8CI,9CI); 2-Phenoxyacetaldehyde; 2-Phenoxyethanal; NSC 49355;Phenoxyacetaldehyde

Chemical Property of CORTEX ALDEHYDE 50 BENZYL ALCOHOL

Chemical Property:

• Vapor Pressure: 0.113mmHg at 25°C
• Melting Point: 38°C
• Refractive Index: 1.5090 (estimate)
• Boiling Point: 220.4°Cat760mmHg
• Flash Point: 92.4°C
• PSA: 26.30000
• Density: 1.069g/cm³
• LogP: 1.26430
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 136.052429494
• Heavy Atom Count: 10
• Complexity: 95.4

Purity/Quality:

99%, ^*data from raw suppliers

2-Phenoxyacetaldehyde 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCC=O

Technology Process of CORTEX ALDEHYDE 50 BENZYL ALCOHOL

There total 33 articles about CORTEX ALDEHYDE 50 BENZYL ALCOHOL 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%

(2,2-diethoxy-ethoxy)-benzene (32438-31-6) → 2-phenoxyethanal (2120-70-9)

Guidance literature:

With hydrogenchloride; water; acetic acid; In ethanol; for 3h; Heating / reflux;

Reference yield: 96.0%

2-phenoxyacetaldehyde dimethyl acetal (67874-68-4) → 2-phenoxyethanal (2120-70-9)

Guidance literature:

With amberlyst-15; In acetonitrile; at 20 ℃; for 8h;

DOI:10.1002/hlca.200390212

Reference yield: 94.0%

methyl 2-phenoxyacetate (2065-23-8) → 2-phenoxyethanal (2120-70-9)

Guidance literature:

With diisobutylaluminium hydride; In tetrahydrofuran; at -70 ℃; for 1.5h;

upstream raw materials:

2-Phenoxyethanol

3-phenoxy-1,2-propanediol

(2,2-diethoxy-ethoxy)-benzene

Phenoxyacetyl chloride

Downstream raw materials:

4-phenoxy-trans-crotonic acid

2-(2,2-dicyano-1-phenoxymethyl-ethyl)-acetoacetic acid ethyl ester

1-benzofurane

(+/-)-1-isopropylamino-3-phenoxypropan-2-ol

Refernces

• 1、 -. "COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF". Paragraph 0251; 0249. . Retrieved 2020/07/07.
• 2、 Fletcher, Stephen P.,Goetzke, F. Wieland,Ku?era, Roman. "An Asymmetric Suzuki-Miyaura Approach to Prostaglandins: Synthesis of Tafluprost". supporting information. . Retrieved 2020/04/09.