butyl 3-chlorobenzoate

Base Information

• Chemical Name: butyl 3-chlorobenzoate
• CAS No.: 63987-54-2
• Molecular Formula: C11H13 Cl O2
• Molecular Weight: 212.676
• Mol file: 63987-54-2.mol

Synonyms:Butylm-chlorobenzoate; NSC 67896; n-Butyl 3-chlorobenzoate; n-Butyl m-chlorobenzoate

Chemical Property of butyl 3-chlorobenzoate

Chemical Property:

• Vapor Pressure: 0.00311mmHg at 25°C
• Boiling Point: 283.7°C at 760 mmHg
• Flash Point: 133.2°C
• PSA: 26.30000
• Density: 1.126g/cm³
• LogP: 3.29690

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of butyl 3-chlorobenzoate

There total 17 articles about butyl 3-chlorobenzoate 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: 84.0%

n-Butyl chloride (109-69-3) + 3-chlorobenzoate (535-80-8) → n-butyl 3-chlorobenzoate (63987-54-2)

Guidance literature:

With 1,1'-(hexane-1,6-diyl)bis(1,8-diazabicyclo[5.4.0]undec-7-enium) dichlorine; In ethanol; water; at 70 ℃; for 2h; Green chemistry;

DOI:10.1007/s10562-017-2184-4

Reference yield: 84.0%

3'-chloro-propiophenone (34841-35-5) + butan-1-ol (71-36-3) → n-butyl 3-chlorobenzoate (63987-54-2)

Guidance literature:

With pyridine; chlorobenzene; copper(I) bromide; at 130 ℃; for 24h;

DOI:10.1021/ja5073004

Reference yield: 80.0%

3-chloro-benzeneacetonitrile (1529-41-5) + butan-1-ol (71-36-3) → n-butyl 3-chlorobenzoate (63987-54-2)

Guidance literature:

With pyridine; ferric(III) bromide; oxygen; In chlorobenzene; at 130 ℃; for 9h; Sealed tube;

DOI:10.1021/acs.joc.6b01594

upstream raw materials:

3-chlorobenzaldehyde di-n-butyl acetal

1-iodo-butane

sodium nitrocyanoamide

butyl (3-chlorophenyl)methyl ether

Refernces

• 1、 Liu, Yang,Mao, Guijie,Zhao, Hongyan,Song, Jinyi,Han, Huatao,Li, Zhuofei,Chu, Wenyi,Sun, Zhizhong. "DBU-Based Dicationic Ionic Liquids Promoted Esterification Reaction of Carboxylic Acid with Primary Chloroalkane Under Mild Conditions". . p. 2764 - 2771. Retrieved 2017/09/14.
• 2、 -. "Synthetic method of an ester compound". Paragraph 0060; 0061; 0062. . Retrieved 2017/02/02.