1-(3,4-Dichlorophenyl)-3-methylurea

Base Information Edit

Chemical Name:1-(3,4-Dichlorophenyl)-3-methylurea
CAS No.:3567-62-2
Molecular Formula:C8H8 Cl2 N2 O
Molecular Weight:219.07
Hs Code.:2924299090
European Community (EC) Number:622-767-6
UNII:Z19W74Z2N4
DSSTox Substance ID:DTXSID3042180
Nikkaji Number:J124.916I
Wikidata:Q27156849
ChEMBL ID:CHEMBL3181859
Mol file:3567-62-2.mol

Synonyms:1-(3,4-Dichlorophenyl)-3-methylurea;3567-62-2;N-Demethoxylinuron;Monomethyldiuron;N-(3,4-Dichlorophenyl)-N'-methylurea;N-Demethoxy Linuron;diuron-desmethyl;1-(3,4-dichlorophenyl)-3-methyl urea;Dcpmu;Urea, N-(3,4-dichlorophenyl)-N'-methyl-;3-(3,4-Dichlorophenyl)-1-methylurea;BRN 2805599;N-Demethoxylinuron-13C6;N-Methyl-N'-(3,4-dichlorophenyl)urea;UNII-Z19W74Z2N4;Urea, 1-(3,4-dichlorophenyl)-3-methyl-;DTXSID3042180;CHEBI:83466;Z19W74Z2N4;Desmethyldiuron;3,4-DCPMU;Desmethoxy-linuron;diuron TP1;Diuron-desmonomethyl;1-Methyl-3-(3,4-dichlorophenyl)urea;N-methyl-N'-(3',4'-dichlorophenyl)-urea;SCHEMBL2893642;CHEMBL3181859;DTXCID1022180;Tox21_301892;MFCD00088374;1(3,4-Dichlorophenyl)-3-methylurea;AKOS017100445;N-methyl-N'-(3,4-dichlorophenyl)-urea;NCGC00255937-01;AS-56949;CAS-3567-62-2;LS-159759;FT-0665722;N'-(3,4-DICHLOROPHENYL)-N-METHYLUREA;Q27156849;Urea, 1-(3,4-dichlorophenyl)-3-methyl- (6CI,7CI,8CI);1-(3,4-Dichlorophenyl)-3-methylurea 100 microg/mL in Acetonitrile

Suppliers and Price of 1-(3,4-Dichlorophenyl)-3-methylurea

Supply Marketing:Edit

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
N-DemethoxyLinuron
250mg
$ 135.00

Sigma-Aldrich
1-(3,4-DICHLOROPHENYL)-3-METHYLUREA AldrichCPR
250mg
$ 168.00

Medical Isotopes, Inc.
N-DemethoxyLinuron
1 g
$ 2120.00

Biosynth Carbosynth
N-Demethoxy linuron
250 mg
$ 462.50

Biosynth Carbosynth
N-Demethoxy linuron
100 mg
$ 255.00

Biosynth Carbosynth
N-Demethoxy linuron
50 mg
$ 140.00

Biosynth Carbosynth
N-Demethoxy linuron
1 g
$ 1528.80

Biosynth Carbosynth
N-Demethoxy linuron
500 mg
$ 840.00

American Custom Chemicals Corporation
1-(3,4-DICHLOROPHENYL)-3-METHYL UREA 95.00%
1G
$ 1871.10

American Custom Chemicals Corporation
1-(3,4-DICHLOROPHENYL)-3-METHYL UREA 95.00%
100MG
$ 739.20

Total 20 raw suppliers

Chemical Property of 1-(3,4-Dichlorophenyl)-3-methylurea Edit

Chemical Property:

Vapor Pressure:0.00154mmHg at 25°C
Melting Point:155.5 °C
Boiling Point:295.3°Cat760mmHg
PKA:13.50±0.70(Predicted)
Flash Point:132.4°C
PSA：41.13000
Density:1.411g/cm³
LogP:3.20860
Storage Temp.:Refrigerator
Solubility.:Chloroform (Slightly, Heated), DMSO (Slightly), Methanol (Slightly)
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:218.0013683
Heavy Atom Count:13
Complexity:189

Purity/Quality:

99%, ^*data from raw suppliers

N-DemethoxyLinuron ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CNC(=O)NC1=CC(=C(C=C1)Cl)Cl
Uses A metabolite of herbicide Diuron (D494415) and Linuron (L468500). It was investigated in wheat and radish.

Technology Process of 1-(3,4-Dichlorophenyl)-3-methylurea

There total 7 articles about 1-(3,4-Dichlorophenyl)-3-methylurea 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: 72.0%

: 102-36-3
3,4-dichlorophenylisocyanate

: 74-89-5
methylamine

: 3567-62-2
3-(3,4-Dichlorophenyl)-1-methylurea

Guidance literature:: In tetrahydrofuran; at 20 ℃; for 2h;
DOI:10.1002/(SICI)1526-4998(200005)56:5<455::AID-PS152>3.0.CO;2-Z

Reference yield:

: 624-83-9
methyl isocyanate

: 95-76-1
m,p-dichloroaniline

: 3567-62-2
3-(3,4-Dichlorophenyl)-1-methylurea

Guidance literature:: In di-isopropyl ether;

Reference yield:

: 102-36-3
3,4-dichlorophenylisocyanate

: 3567-62-2
3-(3,4-Dichlorophenyl)-1-methylurea

Guidance literature:: Multi-step reaction with 2 steps

1: toluene

2: aq. HCl

With hydrogenchloride; In toluene;
DOI:10.1021/jo01270a038