N-(1,3-benzothiazol-2-yl)-3-chloropropanamide

Base Information

Chemical Name:N-(1,3-benzothiazol-2-yl)-3-chloropropanamide
CAS No.:2877-36-3
Molecular Formula:C10H9ClN2OS
Molecular Weight:240.713
Hs Code.:2934999090
DSSTox Substance ID:DTXSID40389543
Wikidata:Q82185423
Mol file:2877-36-3.mol

Synonyms:2877-36-3;N-(1,3-benzothiazol-2-yl)-3-chloropropanamide;N-1,3-BENZOTHIAZOL-2-YL-3-CHLOROPROPANAMIDE;N-(Benzo[d]thiazol-2-yl)-3-chloropropanamide;DTXSID40389543;MFCD01213665;STK293604;AKOS000197496;LS-05210;FT-0684063;SR-01000355933;SR-01000355933-1

Suppliers and Price of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide

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

Matrix Scientific
N-1,3-Benzothiazol-2-yl-3-chloropropanamide
500mg
$ 95.00

Crysdot
N-(Benzo[d]thiazol-2-yl)-3-chloropropanamide 95+%
5g
$ 297.00

Chemenu
N-(Benzo[d]thiazol-2-yl)-3-chloropropanamide 95%
5g
$ 281.00

ChemBridge Corporation
N-1,3-benzothiazol-2-yl-3-chloropropanamide 95%
1 g
$ 46.00

ChemBridge Corporation
N-1,3-benzothiazol-2-yl-3-chloropropanamide 95%
5 g
$ 133.00

Biosynth Carbosynth
N-1,3-Benzothiazol-2-yl-3-chloropropanamide
1 g
$ 105.00

Biosynth Carbosynth
N-1,3-Benzothiazol-2-yl-3-chloropropanamide
500 mg
$ 60.00

Biosynth Carbosynth
N-1,3-Benzothiazol-2-yl-3-chloropropanamide
2 g
$ 179.00

Biosynth Carbosynth
N-1,3-Benzothiazol-2-yl-3-chloropropanamide
10 g
$ 609.00

Biosynth Carbosynth
N-1,3-Benzothiazol-2-yl-3-chloropropanamide
5 g
$ 358.00

Total 7 raw suppliers

Chemical Property of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide

Chemical Property:

Melting Point:192 °C(Solv: ethanol (64-17-5); acetone (67-64-1))
PKA:9.70±0.70(Predicted)
PSA：70.23000
Density:1.439g/cm³
LogP:2.93670
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:240.0124118
Heavy Atom Count:15
Complexity:240

Purity/Quality:

98%min ^*data from raw suppliers

N-1,3-Benzothiazol-2-yl-3-chloropropanamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)N=C(S2)NC(=O)CCCl

Technology Process of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide

There total 4 articles about N-(1,3-benzothiazol-2-yl)-3-chloropropanamide 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: 60.0%

: 136-95-8,102337-98-4,84293-42-5
2-amino-benzthiazole

: 625-36-5
2-chloropropionyl chloride

: 2877-36-3
β-chloropropionyl-2-aminobenzothiazole

Guidance literature:: With triethylamine; In benzene; for 2h; Heating;

Reference yield:

: 62-53-3
aniline

: 2877-36-3
β-chloropropionyl-2-aminobenzothiazole

Guidance literature:: Multi-step reaction with 2 steps

1: bromine; formic acid; acetic acid / 0 - 20 °C

2: N-ethyl-N,N-diisopropylamine / tetrahydrofuran / 0 - 20 °C

With formic acid; bromine; acetic acid; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran;
DOI:10.1016/j.ejmech.2018.09.068