4-(Methylthio)benzoic acid

Base Information

Chemical Name:4-(Methylthio)benzoic acid
CAS No.:13205-48-6
Molecular Formula:C8H8O2S
Molecular Weight:168.216
Hs Code.:29309090
European Community (EC) Number:236-171-5
NSC Number:400301
UNII:Q4SWG87DXN
DSSTox Substance ID:DTXSID80157324
Nikkaji Number:J124.158C
Wikidata:Q15726103
ChEMBL ID:CHEMBL99816
Mol file:13205-48-6.mol

Synonyms:4-(methylthio)benzoic acid;4-MTB

Suppliers and Price of 4-(Methylthio)benzoic 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

AK Scientific
4-(Methylthio)benzoic acid
5g
$ 131.00

AK Scientific
4-(Methylthio)benzoic acid
25g
$ 251.00

Alfa Aesar
4-(Methylthio)benzoic acid, 97%
25g
$ 424.00

Alfa Aesar
4-(Methylthio)benzoic acid, 97%
5g
$ 104.00

Alfa Aesar
4-(Methylthio)benzoic acid, 97%
1g
$ 32.20

American Custom Chemicals Corporation
4-(METHYLTHIO)BENZOIC ACID 95.00%
1G
$ 660.35

American Custom Chemicals Corporation
4-(METHYLTHIO)BENZOIC ACID 95.00%
25G
$ 1774.26

Atlantic Research Chemicals
4-(Methylthio)benzoic acid 95%
1gm:
$ 31.81

Chemenu
4-(Methylthio)benzoic acid 95+%
500g
$ 693.00

Crysdot
4-(Methylthio)benzoic acid 97%
500g
$ 741.00

Total 81 raw suppliers

Chemical Property of 4-(Methylthio)benzoic acid

Chemical Property:

Appearance/Colour:light yellow to beige crystalline powder
Vapor Pressure:0.000145mmHg at 25°C
Melting Point:192-196 °C(lit.)
Boiling Point:319 °C at 760 mmHg
PKA:4.28±0.10(Predicted)
Flash Point:146.7 °C
PSA：62.60000
Density:1.28 g/cm³
LogP:2.10670
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:168.02450067
Heavy Atom Count:11
Complexity:139

Purity/Quality:

99% ^*data from raw suppliers

4-(Methylthio)benzoic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 36/37/38-22
Safety Statements: 22-24/25-37/39-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CSC1=CC=C(C=C1)C(=O)O

Technology Process of 4-(Methylthio)benzoic acid

There total 43 articles about 4-(Methylthio)benzoic 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: 98.0%