5-(4-Chlorophenyl)-3-methyl-1,2,4-thiadiazole

Base Information

Chemical Name:5-(4-Chlorophenyl)-3-methyl-1,2,4-thiadiazole
CAS No.:74466-94-7
Molecular Formula:C9H7 Cl N2 S
Molecular Weight:210.68
Hs Code.:
DSSTox Substance ID:DTXSID70372342
Wikidata:Q82160005
Mol file:74466-94-7.mol

Synonyms:5-(4-chlorophenyl)-3-methyl-1,2,4-thiadiazole;74466-94-7;Maybridge3_006523;SCHEMBL2361575;DTXSID70372342;HMS1449I11;MFCD00207804;CCG-248197;IDI1_017910;FT-0619647;Z1269151224;5-(4-chlorophenyl)-3-methyl-1,2,4-thiadiazole, AldrichCPR

Suppliers and Price of 5-(4-Chlorophenyl)-3-methyl-1,2,4-thiadiazole

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
5-(4-CHLOROPHENYL)-3-METHYL-1,2,4-THIADIAZOLE 95.00%
10G
$ 1438.25

American Custom Chemicals Corporation
5-(4-CHLOROPHENYL)-3-METHYL-1,2,4-THIADIAZOLE 95.00%
1G
$ 659.00

Total 11 raw suppliers

Chemical Property of 5-(4-Chlorophenyl)-3-methyl-1,2,4-thiadiazole

Chemical Property:

Vapor Pressure:0.000213mmHg at 25°C
Melting Point:81-83
Boiling Point:336.9°C at 760 mmHg
Flash Point:157.5°C
PSA：54.02000
Density:1.326g/cm³
LogP:3.16690
XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:210.0018471
Heavy Atom Count:13
Complexity:171

Purity/Quality:

98%min ^*data from raw suppliers

5-(4-CHLOROPHENYL)-3-METHYL-1,2,4-THIADIAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NSC(=N1)C2=CC=C(C=C2)Cl

Technology Process of 5-(4-Chlorophenyl)-3-methyl-1,2,4-thiadiazole

There total 2 articles about 5-(4-Chlorophenyl)-3-methyl-1,2,4-thiadiazole 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: 75.0%

: 74466-83-4
4-Chloro-N-[1-dimethylamino-eth-(E)-ylidene]-thiobenzamide

: 74466-94-7
5-(4-Chloro-phenyl)-3-methyl-[1,2,4]thiadiazole

Guidance literature:: With mesitylenesulfonylhydroxylamine; In dichloromethane; 1) 0 deg C, 1-2 min, 2) room temperature, 2h;
DOI:10.1021/jo01307a006

Reference yield:

: 2521-24-6
4-chlorothiobenzamide

: 74466-94-7
5-(4-Chloro-phenyl)-3-methyl-[1,2,4]thiadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 91 percent / Ambient temperature

2: 75 percent / O-(mesitylenesulfonyl)hydroxylamine / CH₂Cl₂ / 1) 0 deg C, 1-2 min, 2) room temperature, 2h

With mesitylenesulfonylhydroxylamine; In dichloromethane;
DOI:10.1021/jo01307a006