N-(6-Methyl-1,3-benzothiazol-2-yl)urea

Base Information

Chemical Name:N-(6-Methyl-1,3-benzothiazol-2-yl)urea
CAS No.:90564-99-1
Molecular Formula:C₉H₉N₃OS
Molecular Weight:207.256
Hs Code.:
DSSTox Substance ID:DTXSID00560351
Wikidata:Q82443384
Mol file:90564-99-1.mol

Synonyms:90564-99-1;N-(6-Methyl-1,3-benzothiazol-2-yl)urea;SCHEMBL13486495;DTXSID00560351;AKOS000162135

Suppliers and Price of N-(6-Methyl-1,3-benzothiazol-2-yl)urea

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

Total 3 raw suppliers

Chemical Property of N-(6-Methyl-1,3-benzothiazol-2-yl)urea

Chemical Property:

Melting Point:295 °C
PKA:8.59±0.70(Predicted)
PSA：97.24000
Density:1.451±0.06 g/cm3(Predicted)
LogP:2.68210
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:207.04663309
Heavy Atom Count:14
Complexity:236

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC2=C(C=C1)N=C(S2)NC(=O)N

Technology Process of N-(6-Methyl-1,3-benzothiazol-2-yl)urea

There total 5 articles about N-(6-Methyl-1,3-benzothiazol-2-yl)urea 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:

: 2536-91-6
6-methylbenzothiazol-2-ylamine

: 917-61-3
sodium isocyanate

: 90564-99-1
(6-methyl-benzothiazol-2-yl)-urea

Guidance literature:: With acetic acid; In ethanol; water; Heating;
DOI:10.1016/j.bmcl.2007.05.048

Reference yield:

: 2536-91-6
6-methylbenzothiazol-2-ylamine

: 90564-99-1
(6-methyl-benzothiazol-2-yl)-urea

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether / 40 - 60 °C

2: aq. HCl / 1 h / Heating

With hydrogenchloride; In diethyl ether;

Reference yield:

: 106-49-0,12221-03-3
p-toluidine

: 90564-99-1
(6-methyl-benzothiazol-2-yl)-urea

Guidance literature:: Multi-step reaction with 2 steps

1: bromine; acetic acid / 4 h / -10 - 0 °C

2: acetic acid / water / Heating

With bromine; acetic acid; In water;
DOI:10.1016/j.ejmech.2013.06.026