1,4-Bis(bromomethyl)-2-iodobenzene

Base Information

• Chemical Name: 1,4-Bis(bromomethyl)-2-iodobenzene
• CAS No.: 60017-02-9
• Molecular Formula: C8H7Br2I
• Molecular Weight: 389.856
• European Community (EC) Number: 830-986-5
• DSSTox Substance ID: DTXSID90484012
• Wikidata: Q82321955
• Mol file: 60017-02-9.mol

Synonyms:1,4-bis(bromomethyl)-2-iodobenzene;60017-02-9;Benzene, 1,4-bis(bromomethyl)-2-iodo-;SCHEMBL6629667;DTXSID90484012;AKOS037651981;CS-0256652;EN300-6504700

Chemical Property of 1,4-Bis(bromomethyl)-2-iodobenzene

Chemical Property:

• PSA: 0.00000
• LogP: 4.08100
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 389.79387
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

99% ^*data from raw suppliers

1,4-Bis(bromomethyl)-2-iodobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1CBr)I)CBr

Technology Process of 1,4-Bis(bromomethyl)-2-iodobenzene

There total 2 articles about 1,4-Bis(bromomethyl)-2-iodobenzene 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: 27.0%

2-iodo-p-xylene (1122-42-5) → 1,4-bis(bromomethyl)-2-iodobenzene (60017-02-9)

Guidance literature:

With N-Bromosuccinimide; 1,1'-azobis(1-cyanocyclohexanenitrile); In 1,2-dichloro-ethane; Heating; irradiation;

DOI:10.1016/j.bmc.2004.01.026

Reference yield:

(2-iodo-1,4-phenylene)dimethanol → 1,4-bis(bromomethyl)-2-iodobenzene (60017-02-9)

Guidance literature:

With carbon tetrabromide; triphenylphosphine; In dichloromethane; at 25 ℃; for 16h; Inert atmosphere;

Reference yield: 87.13%

1,4-bis(bromomethyl)-2-iodobenzene (60017-02-9) + 1,3-bis(tertbutoxycarbonyl)guanidine → C19H27Br(127)IN3O4

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; paraffin oil; at 0 ℃; for 0.25h; Inert atmosphere;

DOI:10.1039/d1ra04054e

upstream raw materials:

2-iodo-p-xylene

Downstream raw materials:

C₂₈H₄₅IN₄O₂

1,4-bis-[(N,N'-bis-tert-butyloxycarbonyl)guanidinomethyl]-2-iodobenzene

tetraethyl 1,4-bis(phosphonomethyl)-2-iodobenzene

(E,E)-2,5-bis(4’-hydroxy-3’-carbomethoxystyryl)-1-iodobenzene