CHEMBRDG-BB 4024926

Base Information

• Chemical Name: CHEMBRDG-BB 4024926
• CAS No.: 16183-39-4
• Molecular Formula: C11H16ClN
• Molecular Weight: 197.707
• Hs Code.: 2921499090
• Mol file: 16183-39-4.mol

Synonyms:Benzenemethanamine, N-butyl-2-chloro-;N-(2-Chlorobenzyl)butan-1-amine;

Chemical Property of CHEMBRDG-BB 4024926

Chemical Property:

• Vapor Pressure: 0.00984mmHg at 25°C
• Refractive Index: 1.516
• Boiling Point: 264.2 °C at 760 mmHg
• PKA: 9.11±0.19(Predicted)
• Flash Point: 113.6 °C
• PSA: 12.03000
• Density: 1.026 g/cm³
• LogP: 3.62060

Purity/Quality:

99% ^*data from raw suppliers

N-(2-Chlorobenzyl)butan-1-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of CHEMBRDG-BB 4024926

There total 3 articles about CHEMBRDG-BB 4024926 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: 92.0%

N-2-chlorobenzylidene(butyl)amine (16183-19-0) → N-(2′-chlorobenzyl)-1-butylamine (16183-39-4)

Guidance literature:

With trichlorosilane; In N,N-dimethyl-formamide; toluene; at 15 - 20 ℃; for 16h; Inert atmosphere;

DOI:10.1021/acs.joc.1c01561

Reference yield: 81.0%

N-butyl-2-chlorobenzamide (62797-97-1) → N-(2′-chlorobenzyl)-1-butylamine (16183-39-4)

Guidance literature:

With dimethylsulfide borane complex; In toluene; for 2h; Heating;

DOI:10.1080/00397919108021056

Reference yield:

2-chloro-benzaldehyde (89-98-5) → N-(2′-chlorobenzyl)-1-butylamine (16183-39-4)

Guidance literature:

Multi-step reaction with 2 steps

1: toluene / 20 °C / Molecular sieve

2: trichlorosilane / toluene; N,N-dimethyl-formamide / 16 h / 15 - 20 °C / Inert atmosphere

With trichlorosilane; In N,N-dimethyl-formamide; toluene;

DOI:10.1021/acs.joc.1c01561

upstream raw materials:

N-butyl-2-chlorobenzamide

2-chloro-benzaldehyde

N-2-chlorobenzylidene(butyl)amine

Refernces

• 1、 Bonnat,Hercouet,Le Corre. "Effect of the temperature on the stoichiometry of borane dimethyl sulfide reduction of secondary and tertiary amides". . p. 1579 - 1582. Retrieved 2007/10/02.