Bromochloromethyl acetate

Base Information

• Chemical Name: Bromochloromethyl acetate
• CAS No.: 98136-99-3
• Molecular Formula: C₂H₂BrClO
• Molecular Weight: 157.394
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID9021504
• Nikkaji Number: J2.067.069J
• Mol file: 98136-99-3.mol

Synonyms:[bromo(chloro)methyl] acetate;Bromochloromethyl acetate;bromo(chloro)methyl acetate;DTXSID9021504;Acetic acid bromochloromethyl ester

Chemical Property of Bromochloromethyl acetate

Chemical Property:

• PSA: 17.07000
• LogP: 1.14510
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 185.90832
• Heavy Atom Count: 7
• Complexity: 75.3

Purity/Quality:

97% ^*data from raw suppliers

Bromochloroacetaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC(Cl)Br
• Uses: A dihalogen-substitued acetaldehyde (HA). Classified as a disinfection byproduct (DBP), commonly found in water treatment plants.

Technology Process of Bromochloromethyl acetate

There total 1 articles about Bromochloromethyl 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:

O,O-Diethyl-O-(2-chlorvinyl-phosphat (311-47-7) → bromochloroacetaldehyde (98136-99-3)

Guidance literature:

With tetrachloromethane; bromine; Irradiation_.UV-Licht;

DOI:10.1021/ja01596a044

upstream raw materials:

O,O-Diethyl-O-(2-chlorvinyl-phosphat