Isoproturon-d6

Base Information

Chemical Name:Isoproturon-d6
CAS No.:217487-17-7
Molecular Formula:C₁₂H₁₈N₂O
Molecular Weight:206.288
Hs Code.:
European Community (EC) Number:634-978-0
DSSTox Substance ID:DTXSID50583575
Nikkaji Number:J2.162.376H
Wikidata:Q82475156
Mol file:217487-17-7.mol

Synonyms:Isoproturon-d6;217487-17-7;3-(4-Isopropylphenyl)-1,1-dimethylurea-d6;3-(4-propan-2-ylphenyl)-1,1-bis(trideuteriomethyl)urea;1007461-76-8;Isoproturon D6 (dimethyl D6);Isoproturon D6 (dimethyl D6) 100 microg/mL in Acetone;DTXSID50583575;Isoproturon D6 (dimethyl D6) 1000 microg/mL in Acetonitrile;Isoproturon-d6, PESTANAL(R), analytical standard;J-014270;3,3-di(?H?)methyl-1-[4-(propan-2-yl)phenyl]urea;N,N-Bis[(~2~H_3_)methyl]-N'-[4-(propan-2-yl)phenyl]urea

Suppliers and Price of Isoproturon-d6

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

TRC
Isoproturon-d6
1mg
$ 105.00

TRC
Isoproturon-d6
5mg
$ 360.00

Sigma-Aldrich
Isoproturon-d6 PESTANAL?,analyticalstandard
10 mg
$ 139.00

Sigma-Aldrich
Isoproturon-d6 PESTANAL
10mg-r
$ 135.00

American Custom Chemicals Corporation
ISOPROTURON D6 95.00%
5MG
$ 503.25

Total 8 raw suppliers

Chemical Property of Isoproturon-d6

Chemical Property:

Vapor Pressure:3.64E-05mmHg at 25°C
Refractive Index:1.555
Boiling Point:353.2°C at 760 mmHg
Flash Point:167.4°C
PSA：32.34000
Density:1.081g/cm³
LogP:2.97650
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:212.179573678
Heavy Atom Count:15
Complexity:206

Purity/Quality:

99%, ^*data from raw suppliers

Isoproturon-d6 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn,N
Statements: 40-50/53
Safety Statements: 36/37-60-61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)C1=CC=C(C=C1)NC(=O)N(C)C
Isomeric SMILES:[2H]C([2H])([2H])N(C(=O)NC1=CC=C(C=C1)C(C)C)C([2H])([2H])[2H]
Uses Isoproturon-d6 is deuterized or labeled form of Isoproturon (I874500), which is a pre-and post emergence herbicide for control of annual grasses and broad-leaved weeds. Herbicide.

Technology Process of Isoproturon-d6

There total 9 articles about Isoproturon-d6 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: 98.0%

: 99-88-7
4-Isopropylaniline

: 79-44-7
N,N-Dimethylcarbamoyl chloride

: 34123-59-6,217487-17-7
N-(4-isopropylphenyl)-N',N'-dimethylurea

Guidance literature:: With sodium carbonate; sodium iodide; In hexane; at 50 ℃; for 16h; pH=7;
DOI:10.1055/s-0028-1083340

Reference yield: 80.0%

: 506-59-2
N,N-dimethylammonium chloride

: 3-(4-isopropylphenyl)-1,4,2-dioxazol-5-one

: 34123-59-6,217487-17-7
N-(4-isopropylphenyl)-N',N'-dimethylurea

Guidance literature:: With 2,2,2-trifluoroethanol; triethylamine; at 50 ℃; for 18h;
DOI:10.1080/00397911.2021.1983605

Reference yield: 76.0%

: 31027-31-3
4-isopropylphenylisocyanate

: 506-59-2
N,N-dimethylammonium chloride

: 34123-59-6,217487-17-7
N-(4-isopropylphenyl)-N',N'-dimethylurea

Guidance literature:: 4-isopropylphenylisocyanate; N,N-dimethylammonium chloride; In tetrachloromethane; for 0.333333h; Inert atmosphere;

With triethylamine; In tetrachloromethane; at 20 ℃; for 16h;