5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester

Base Information

Chemical Name:5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester
CAS No.:49702-16-1
Molecular Formula:C₁₇H₁₅NO₂S
Molecular Weight:297.378
Hs Code.:
DSSTox Substance ID:DTXSID30197977
Nikkaji Number:J65.526K
Wikidata:Q83070736
ChEMBL ID:CHEMBL1531806
Mol file:49702-16-1.mol

Synonyms:BRN 1005503;Ethyl 2-phenyl-5-benzothiazoleacetate;MLS000564000;5-BENZOTHIAZOLEACETIC ACID, 2-PHENYL-, ETHYL ESTER;(2-Phenyl-benzothiazol-5-yl)-acetic acid ethyl ester;49702-16-1;SMR000174962;C17H15NO2S;Enamine_001510;cid_39508;ethyl 2-(2-phenyl-1,3-benzothiazol-5-yl)acetate;CHEMBL1531806;BDBM49597;DTXSID30197977;HMS1398E14;HMS2547N04;AKOS000523920;NCGC00245117-01;LS-40657;2-Phenyl-5-benzothiazoleacetic acid ethyl ester;ethyl 2-(2-phenyl-1,3-benzothiazol-5-yl)ethanoate;Z56800697;2-(2-phenyl-1,3-benzothiazol-5-yl)acetic acid ethyl ester

Suppliers and Price of 5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester

Chemical Property:

Vapor Pressure:4.28E-08mmHg at 25°C
Boiling Point:444.4°C at 760 mmHg
Flash Point:222.6°C
Density:1.234g/cm³
XLogP3:4.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:297.08234989
Heavy Atom Count:21
Complexity:357

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CC1=CC2=C(C=C1)SC(=N2)C3=CC=CC=C3

Technology Process of 5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester

There total 1 articles about 5-Benzothiazoleacetic acid, 2-phenyl-, ethyl ester 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:

: 49702-16-1
(2-phenyl-benzothiazol-5-yl)-acetic acid ethyl ester

Guidance literature:: /BRN= 76931//A., HClO4(70percent), Tl(NO3)3*3H2O/A., HClO4;

Reference yield:

: 49702-16-1
(2-phenyl-benzothiazol-5-yl)-acetic acid ethyl ester

: 49702-18-3
N-hydroxy-2-(2-phenyl-benzothiazol-5-yl)-acetamide

Guidance literature:: With hydroxylamine hydrochloride; sodium methylate; In methanol;
DOI:10.1021/jm00266a013

Reference yield:

: 49702-16-1
(2-phenyl-benzothiazol-5-yl)-acetic acid ethyl ester

: 52321-51-4
(3-methyl-2-phenyl-2,3-dihydro-benzothiazol-5-yl)-acetic acid

Guidance literature:: Multi-step reaction with 4 steps

1: NaOEt

2: NaOEt

3: (i) H₂SO₄, (ii) NaBH₄

4: KOH / methanol

With potassium hydroxide; sodium ethanolate; In methanol;
DOI:10.1021/jm00251a004