5-Methylsulfanylthiophene-2-carboxylic acid

Base Information

Chemical Name:5-Methylsulfanylthiophene-2-carboxylic acid
CAS No.:20873-58-9
Molecular Formula:C6H6O2S2
Molecular Weight:174.24
Hs Code.:29349990
DSSTox Substance ID:DTXSID70351935
Wikidata:Q72491680
ChEMBL ID:CHEMBL450866
Mol file:20873-58-9.mol

Synonyms:20873-58-9;5-methylsulfanylthiophene-2-carboxylic acid;5-(methylthio)thiophene-2-carboxylic acid;2-thiophenecarboxylic acid, 5-(methylthio)-;5-(methylsulfanyl)thiophene-2-carboxylic acid;CHEMBL450866;Maybridge1_007717;ChemDiv2_000116;5-(Methylsulphanyl)thiophene-2-carboxylic acid;Cambridge id 5103856;SCHEMBL2723219;HMS563G17;DTXSID70351935;FWFWUSLBIIIIEN-UHFFFAOYSA-N;HMS1369F06;BBL104086;BDBM50261993;CCG-47480;MFCD00173742;SEW 03638;STL557901;5-methylmercaptothiophene-2-carboxylic;AKOS000313662;CS-W017496;SB67104;5-methylthio-2-thiophenecarboxylic acid;NCGC00328567-01;5-methylsulfanylthiophene-2-carboxylicacid;PD182423;TS-00170;5-(methylthio)-2-thiophenecarboxylic acid;FT-0619724;EN300-78012;W17807;AB01321581-02;A814992;SR-01000406260;SR-01000406260-1;SR-01000406260-2;5-(methylthio)thiophene-2-carboxylic acid, AldrichCPR;Z1201619509

Suppliers and Price of 5-Methylsulfanylthiophene-2-carboxylic 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
Packaging
price

TRC
5-(Methylthio)thiophene-2-carboxylicAcid
250mg
$ 85.00

SynQuest Laboratories
5-(Methylthio)thiophene-2-carboxylic acid
250 mg
$ 116.00

SynQuest Laboratories
5-(Methylthio)thiophene-2-carboxylic acid
1 g
$ 221.00

Matrix Scientific
5-Methylsulfanylthiophene-2-carboxylic acid 95+%
250mg
$ 213.00

Matrix Scientific
5-Methylsulfanylthiophene-2-carboxylic acid 95+%
1g
$ 471.00

Frontier Specialty Chemicals
5-(Methylthio)thiophene-2-carboxylicacid 97%
1g
$ 238.00

Crysdot
5-Methylsulfanylthiophene-2-carboxylicacid 95+%
250mg
$ 64.00

Crysdot
5-Methylsulfanylthiophene-2-carboxylicacid 95+%
1g
$ 160.00

Crysdot
5-Methylsulfanylthiophene-2-carboxylicacid 95+%
5g
$ 512.00

Chemenu
5-Methylsulfanylthiophene-2-carboxylicacid 95%
5g
$ 479.00

Total 35 raw suppliers

Chemical Property of 5-Methylsulfanylthiophene-2-carboxylic acid

Chemical Property:

Vapor Pressure:3.88E-05mmHg at 25°C
Melting Point:103 °C
Refractive Index:1.642
Boiling Point:338.2 °C at 760 mmHg
PKA:3.65±0.10(Predicted)
Flash Point:158.4 °C
PSA：90.84000
Density:1.43 g/cm³
LogP:2.16820
Storage Temp.:2-8°C(protect from light)
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:173.98092178
Heavy Atom Count:10
Complexity:138

Purity/Quality:

97% ^*data from raw suppliers

5-(Methylthio)thiophene-2-carboxylicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38-43-20/21/22
Safety Statements: 26-36/37/39-36/37-22

MSDS Files:

Useful:

Canonical SMILES:CSC1=CC=C(S1)C(=O)O
Uses 5-(Methylthio)thiophene-2-carboxylic Acid is used to prepare acylated piperidinylmethyl and azabicyclomethyl pyridinemethanamines as selective 5-HT1a superagonists for potential use in the treatment of CNS disorders.

Technology Process of 5-Methylsulfanylthiophene-2-carboxylic acid

There total 4 articles about 5-Methylsulfanylthiophene-2-carboxylic 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: 93.0%

: 7311-63-9
5-bromothiophene-2-carboxylic acid

: 2949-92-0,31761-75-8
methanethiosulfonic acid S-methyl ester

: 20873-58-9
5-(methylthio)thiophene-2-carboxylic acid

Guidance literature:: 5-bromothiophene-2-carboxylic acid; With methylmagnesium chloride; lithium chloride; In tetrahydrofuran; at -20 ℃; for 0.333333h;

With TurboGrignard; In tetrahydrofuran; at 20 ℃; for 0.5h;

methanethiosulfonic acid S-methyl ester; In tetrahydrofuran; at -20 - 20 ℃; Further stages.;
DOI:10.1039/b618923g