2-Bromo-4-methylphenyl isocyanate

Base Information

Chemical Name:2-Bromo-4-methylphenyl isocyanate
CAS No.:71189-13-4
Molecular Formula:C8H6 Br N O
Molecular Weight:212.046
Hs Code.:
European Community (EC) Number:622-339-9
DSSTox Substance ID:DTXSID40409018
Mol file:71189-13-4.mol

Synonyms:2-Bromo-4-methylphenyl isocyanate;71189-13-4;2-bromo-1-isocyanato-4-methylbenzene;2-Bromo-4-methylphenyl isocyanate, 96%;SCHEMBL3111620;DTXSID40409018;AKOS010078558;EN300-146861

Suppliers and Price of 2-Bromo-4-methylphenyl isocyanate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
2-BROMO-4-METHYLPHENYL ISOCYANATE 95.00%
1G
$ 690.42

Total 4 raw suppliers

Chemical Property of 2-Bromo-4-methylphenyl isocyanate

Chemical Property:

Vapor Pressure:0.0114mmHg at 25°C
Refractive Index:n20/D 1.5770(lit.)
Boiling Point:215-216 °C(lit.)
Flash Point:214 °F
PSA：29.43000
Density:1.494 g/mL at 25 °C(lit.)
LogP:2.72480
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:210.96328
Heavy Atom Count:11
Complexity:177

Purity/Quality:

99% ^*data from raw suppliers

2-BROMO-4-METHYLPHENYL ISOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=C(C=C1)N=C=O)Br

Technology Process of 2-Bromo-4-methylphenyl isocyanate

There total 3 articles about 2-Bromo-4-methylphenyl isocyanate 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:

: 32315-10-9
bis(trichloromethyl) carbonate

2-bromo-p-toluidine: 583-68-6
2-bromo-p-toluidine

: 71189-13-4
2-Bromo-1-isocyanato-4-methyl-benzene

Guidance literature:: In 1,4-dioxane; at 100 ℃; for 5h;
DOI:10.1016/0223-5234(94)90026-4

Reference yield:

: 32315-10-9
bis(trichloromethyl) carbonate

2-bromo-p-toluidine: 583-68-6
2-bromo-p-toluidine

: 88312-99-6
1,3-Bis-(2-bromo-4-methyl-phenyl)-urea

: 71189-13-4
2-Bromo-1-isocyanato-4-methyl-benzene

Guidance literature:: With triethylamine; In tetrahydrofuran; at 0 ℃; for 2h; Title compound not separated from byproducts;
DOI:10.1055/s-2003-41019