4-Methylbenzothiazole

Base Information

Chemical Name:4-Methylbenzothiazole
CAS No.:3048-48-4
Molecular Formula:C8H7NS
Molecular Weight:149.216
Hs Code.:29342000
DSSTox Substance ID:DTXSID00184551
Nikkaji Number:J1.559.405E
Wikidata:Q83055460
Mol file:3048-48-4.mol

Synonyms:3048-48-4;4-methylbenzo[d]thiazole;4-METHYLBENZOTHIAZOLE;4-methyl-1,3-benzothiazole;Benzothiazole, 4-methyl-;4-methyl-Benzothiazole;4-methyl benzothiazole;SCHEMBL288904;DTXSID00184551;PIUXNZAIHQAHBY-UHFFFAOYSA-N;MFCD11975739;CS-0061214;F18224;J-017978

Suppliers and Price of 4-Methylbenzothiazole

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

AccelPharmtech
4-methyl-Benzothiazole 97.00%
5G
$ 2180.00

AccelPharmtech
4-methyl-Benzothiazole 97.00%
25G
$ 4010.00

AK Scientific
4-Methyl-benzothiazole
1g
$ 272.00

Alichem
4-Methylbenzo[d]thiazole
5g
$ 463.50

American Custom Chemicals Corporation
4-METHYLBENZO[D]THIAZOLE 95.00%
5MG
$ 501.09

Chemenu
4-Methylbenzo[d]thiazole 95%
5g
$ 421.00

Crysdot
4-Methylbenzo[d]thiazole 95+%
1g
$ 295.00

Labseeker
4-methylbenzo[d]thiazole 95
5g
$ 1283.00

Labseeker
4-methylbenzo[d]thiazole 95
10g
$ 1467.00

Medical Isotopes, Inc.
4-Methylbenzothiazole
10 g
$ 2120.00

Total 19 raw suppliers

Chemical Property of 4-Methylbenzothiazole

Chemical Property:

Vapor Pressure:0.0393mmHg at 25°C
Refractive Index:1.663
Boiling Point:247.944 °C at 760 mmHg
PKA:1.40±0.10(Predicted)
Flash Point:108.072 °C
PSA：41.13000
Density:1.217 g/cm³
LogP:2.60470
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:149.02992040
Heavy Atom Count:10
Complexity:126

Purity/Quality:

99%, ^*data from raw suppliers

4-methyl-Benzothiazole 97.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C2C(=CC=C1)SC=N2
Uses 4-Methylbenzothiazole is an intermediate used to synthesize 4-Benzothiazoleacetic Acid (B200500) which is used in the synthesis of acyloxyalkyl and aspartyl amidooxyalkyl ketones with ICE-inhibiting activities.

Technology Process of 4-Methylbenzothiazole

There total 7 articles about 4-Methylbenzothiazole 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%

: 1477-42-5
4-methyl-1,3-benzothiazol-2-amine

: 3048-48-4
4-methylbenzo[d]thiazole

Guidance literature:: With Isovaleronitrile; In 1,4-dioxane; at 70 ℃; for 0.5h;

Reference yield: 63.0%

: 127-19-5,116057-81-9
N,N-dimethyl acetamide

: 86749-03-3
6,6′-disulfanediylbis(2-methylaniline)

: 3048-48-4
4-methylbenzo[d]thiazole

Guidance literature:: With tert.-butylhydroperoxide; at 120 ℃; for 12h; Molecular sieve; Inert atmosphere;
DOI:10.1039/c1cc15397h

Reference yield: 54.0%

: 124-38-9,18923-20-1
carbon dioxide

: 76462-17-4
2-methyl 6-mercapto aniline

: 3048-48-4
4-methylbenzo[d]thiazole

Guidance literature:: carbon dioxide; With 1,8-diazabicyclo[5.4.0]undec-7-ene; In 1-methyl-pyrrolidin-2-one; at 70 ℃; for 0.5h; under 760.051 Torr; Schlenk technique;

2-methyl 6-mercapto aniline; With phenylsilane; In 1-methyl-pyrrolidin-2-one; at 70 ℃; for 24h; under 760.051 Torr; Schlenk technique;
DOI:10.1016/j.tet.2017.05.003