1-Bromo-2-isothiocyanato-3,5-dimethylbenzene

Base Information

Chemical Name:1-Bromo-2-isothiocyanato-3,5-dimethylbenzene
CAS No.:140136-71-6
Molecular Formula:C9H8BrNS
Molecular Weight:242.139
Hs Code.:2930909090
DSSTox Substance ID:DTXSID60568792
Mol file:140136-71-6.mol

Synonyms:140136-71-6;1-Bromo-2-isothiocyanato-3,5-dimethylbenzene;2-Bromo-4,6-dimethylphenylisothiocyanate;BENZENE, 1-BROMO-2-ISOTHIOCYANATO-3,5-DIMETHYL-;Benzene, 1-bromo-2-isothiocyanato-3,5-dimethyl- (9CI);DTXSID60568792;MFCD03413207;AKOS017549686;FS-5703;SY065246;2-Bromo-4,6-dimethylphenyl Isothiocyanate

Suppliers and Price of 1-Bromo-2-isothiocyanato-3,5-dimethylbenzene

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-4,6-DIMETHYLPHENYLISOTHIOCYANATE 95.00%
250MG
$ 213.15

Total 2 raw suppliers

Chemical Property of 1-Bromo-2-isothiocyanato-3,5-dimethylbenzene

Chemical Property:

Boiling Point:325.3±42.0 °C(Predicted)
PSA：44.45000
Density:1.39±0.1 g/cm3(Predicted)
LogP:3.80020
XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:240.95608
Heavy Atom Count:12
Complexity:201

Purity/Quality:

98%+ ^*data from raw suppliers

2-BROMO-4,6-DIMETHYLPHENYLISOTHIOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 1-Bromo-2-isothiocyanato-3,5-dimethylbenzene

There total 1 articles about 1-Bromo-2-isothiocyanato-3,5-dimethylbenzene 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: 71.0%

: 39842-01-8
2,4-dimethylphenylisothiocyanate

: 140136-71-6
1-Bromo-2-isothiocyanato-3,5-dimethyl-benzene

Guidance literature:: With 2,6-di-tert-butyl-4-methyl-phenol; copper(ll) bromide; In tetrahydrofuran; at 20 ℃; for 10h;
DOI:10.1007/s10562-017-2234-y