3-Methyl-2-phenyl-5-benzothiazolineacetic acid

Base Information

Chemical Name:3-Methyl-2-phenyl-5-benzothiazolineacetic acid
CAS No.:52321-51-4
Molecular Formula:C₁₆H₁₅NO₂S
Molecular Weight:285.367
Hs Code.:2934999090
DSSTox Substance ID:DTXSID70966705
Nikkaji Number:J67.782E
Mol file:52321-51-4.mol

Synonyms:BRN 0543536;3-Methyl-2-phenyl-5-benzothiazolineacetic acid;52321-51-4;5-BENZOTHIAZOLINEACETIC ACID, 3-METHYL-2-PHENYL-;DTXSID70966705;LS-40876;2,3-Dihydro-3-methyl-2-phenyl-5-benzothiazoleacetic acid;5-Benzothiazoleacetic acid, 2,3-dihydro-3-methyl-2-phenyl-;(3-methyl-2-phenyl-2,3-dihydro-1,3-benzothiazol-5-yl)acetic acid

Suppliers and Price of 3-Methyl-2-phenyl-5-benzothiazolineacetic acid

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
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price

Total 1 raw suppliers

Chemical Property of 3-Methyl-2-phenyl-5-benzothiazolineacetic acid

Chemical Property:

Vapor Pressure:9.69E-11mmHg at 25°C
Boiling Point:498.1°Cat760mmHg
Flash Point:255°C
PSA：65.84000
Density:1.293g/cm³
LogP:3.61940
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:285.08234989
Heavy Atom Count:20
Complexity:356

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(SC2=C1C=C(C=C2)CC(=O)O)C3=CC=CC=C3

Technology Process of 3-Methyl-2-phenyl-5-benzothiazolineacetic acid

There total 4 articles about 3-Methyl-2-phenyl-5-benzothiazolineacetic acid 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:

: 52321-50-3
(3-methyl-2-phenyl-2,3-dihydro-benzothiazol-5-yl)-acetic acid methyl ester

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

Guidance literature:: With potassium hydroxide; In methanol;
DOI:10.1021/jm00251a004

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

Reference yield:

: 36774-74-0
(2-phenyl-benzothiazol-5-yl)-acetic acid

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

Guidance literature:: Multi-step reaction with 2 steps

1: (i) H₂SO₄, (ii) NaBH₄

2: KOH / methanol

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