METHYL 4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTYRATE

Base Information

• Chemical Name: METHYL 4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTYRATE
• CAS No.: 79481-83-7
• Molecular Formula: C15H21 Cl2 N O2
• Molecular Weight: 318.243
• Mol file: 79481-83-7.mol

Synonyms:Chlorambucilmethyl ester

Chemical Property of METHYL 4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTYRATE

Chemical Property:

• Vapor Pressure: 1.1E-07mmHg at 25°C
• Refractive Index: 1.542
• Boiling Point: 432.6°C at 760 mmHg
• Flash Point: 215.4°C
• PSA: 29.54000
• Density: 1.182g/cm³
• LogP: 3.46630

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

METHYL-4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTYRATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of METHYL 4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTYRATE

There total 14 articles about METHYL 4-(4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTYRATE 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: 95.0%

methanol (67-56-1) + chlorambucil chloride (17981-81-6) → methyl 4-(4-(bis(2-chloroethyl)amino)phenyl)butanoate (79481-83-7)

Guidance literature:

In dichloromethane; at 15 - 20 ℃; for 3h; Inert atmosphere;

DOI:10.1016/j.ejmech.2016.10.037

Reference yield: 83.0%

methyl 3-<4-phenyl>butyrate (130198-76-4) → methyl 4-(4-(bis(2-chloroethyl)amino)phenyl)butanoate (79481-83-7)

Guidance literature:

With trichlorophosphate; In toluene; Reflux;

Reference yield: 59.0%

diphenylmethylsilanecarboxylic acid (18414-58-9) + sodium methylate (124-41-4) + N,N-bis(2-chloroethyl)-4-(3-iodopropyl)aniline → methyl 4-(4-(bis(2-chloroethyl)amino)phenyl)butanoate (79481-83-7)

Guidance literature:

With potassium fluoride; propyl cyanide; (4s,6s)-2,4,5,6-tetra(9H-carbazol-9-yl)isophthalonitrile; (2-morpholino-N-(quinolin-8-yl)acetamido)nickel(II) chloride; triethylamine; In N,N-dimethyl-formamide; at 20 ℃; for 20h; Inert atmosphere; Sealed tube; Irradiation;

DOI:10.1021/jacs.1c09170

upstream raw materials:

methyl 3-<4-phenyl>butyrate

methyl 4-(4-aminophenyl)butanoate

methyl 4-(4-nitrophenyl)butanoate

chlorambucil

Downstream raw materials:

chlorambucil

4-(4-(bis(2-(4-hydroxyphenoxy)ethyl)amino)phenyl)butanoic acid

methyl 4-(4-(bis(2-(4-hydroxyphenoxy)ethyl)amino)phenyl)butanoate

N,N-bis(2-chloroethyl)-4-(4-hydroxybutyl)aniline