cyano(3-phenoxyphenyl)methyl acetate

Base Information

• Chemical Name: cyano(3-phenoxyphenyl)methyl acetate
• CAS No.: 61066-87-3
• Molecular Formula: C16H13NO3
• Molecular Weight: 267.284
• Mol file: 61066-87-3.mol

Synonyms:2-(acetoxy)-2-(3-phenoxyphenyl)acetonitrile;α-cyano-3-phenoxybenzyl acetate;(3-phenoxyphenyl)(cyano)methyl acetate;α-cyano-3-phenoxy-benzyl acetate;cyano(3-phenoxyphenyl)methyl acetate;meta-phenoxybenzaldehyde cyanohydrin acetate;

Chemical Property of cyano(3-phenoxyphenyl)methyl acetate

Chemical Property:

• Vapor Pressure: 1.94E-06mmHg at 25°C
• Boiling Point: 394.7±32.0 °C(Predicted)
• PSA: 59.32000
• Density: 1.196±0.06 g/cm3(Predicted)
• LogP: 3.60668

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of cyano(3-phenoxyphenyl)methyl acetate

There total 6 articles about cyano(3-phenoxyphenyl)methyl acetate 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: 96.0%

trimethylsilyl cyanide (7677-24-9) + acetic anhydride (108-24-7) + 3-Phenoxybenzaldehyde (39515-51-0) → alpha-cyano-3-phenoxybenzyl acetate (61066-87-3)

Guidance literature:

With tris(pentafluorophenyl)borate; at 20 ℃; for 3h; Neat (no solvent);

DOI:10.1016/j.tet.2009.06.020

Reference yield: 95.0%

sodium cyanide (143-33-9,25596-52-5) + acetic anhydride (108-24-7) + 3-Phenoxybenzaldehyde (39515-51-0) → alpha-cyano-3-phenoxybenzyl acetate (61066-87-3)

Guidance literature:

In poly(ethylene glycol)-400; at 20 ℃; Cooling with ice; Inert atmosphere;

DOI:10.1080/00304940809458105

Reference yield: 93.0%

Acetyl cyanide (631-57-2) + 3-Phenoxybenzaldehyde (39515-51-0) → alpha-cyano-3-phenoxybenzyl acetate (61066-87-3)

Guidance literature:

With triethylamine; at 20 ℃; for 1h;

DOI:10.1055/s-2005-872096

upstream raw materials:

sodium cyanide

acetic anhydride

3-Phenoxybenzaldehyde

2-hydroxy-2-(3-phenoxyphenyl)acetonitrile

Downstream raw materials:

(R)-2-hydroxy-2-(3-phenoxyphenyl)acetonitrile

(S)-m-phenoxybenzaldehyde cyanohydrin

O-acetyl-(R)-2-hydroxy-2-(3-phenoxyphenyl)acetonitrile

alpha-(m-phenoxyphenyl)propionitrile

Refernces

• 1、 Kadam, Santosh T.,Kim, Sung Soo. "One-pot three components synthesis of O-acetylcyanohydrins with TMSCN, acetic anhydride and carbonyl compounds under solvent-free condition". experimental part. p. 6330 - 6334. Retrieved 2010/01/06.
• 2、 Baeza, Alejandro,Najera, Carmen,Retamosa, Ma. De Gracia,Sansano, Jose M.. "Solvent-free synthesis of cyanohydrin derivatives catalysed by triethylamine". . p. 2787 - 2797. Retrieved 2007/10/03.