2,5-Dimethylbenzenesulfonic acid

Base Information Edit

Chemical Name:2,5-Dimethylbenzenesulfonic acid
CAS No.:609-54-1
Deprecated CAS:81789-92-6
Molecular Formula:C8H10 O3 S
Molecular Weight:186.232
Hs Code.:2904100000
European Community (EC) Number:210-193-5,623-152-5
UNII:L1SEA5QNP9
DSSTox Substance ID:DTXSID5041641
Nikkaji Number:J154.158G
Wikidata:Q27282599
ChEMBL ID:CHEMBL3182118
Mol file:609-54-1.mol

Synonyms:2,5-DIMETHYLBENZENESULFONIC ACID;609-54-1;Benzenesulfonic acid, 2,5-dimethyl-;p-Xylene-2-sulfonic acid;p-Xylene-2-sulphonic acid;2,5-Xylenesulfonic acid;2,5-Dimethyl-benzenesulfonic acid;p-Xylenesulfonic acid;EINECS 210-193-5;UNII-L1SEA5QNP9;L1SEA5QNP9;DTXSID5041641;2,5-Dimethylbenzenesulfonic acid hydrate;p-Xylene-2-sulfonic acid hydrate;sulfo-p-xylylene;2,4-Xylenesulfonic acid hydrate;4-xylene-2-sulfonate;609-54-1 anhydrous;SCHEMBL246828;CHEMBL3182118;DTXCID3021641;xylate (p-xylene-2-sulphonate);2,5-dimethylbenzene-1-sulfonate;xylate (p-xylene-2-sulfonic acid);Tox21_301014;STK368002;AKOS003239445;NCGC00248254-01;NCGC00254916-01;AM101013;AS-12218;CAS-609-54-1;J154.158G;CS-0094854;D0681;FT-0610454;D75645;A832970;Q27282599

Suppliers and Price of 2,5-Dimethylbenzenesulfonic acid

Supply Marketing:Edit

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

TCI Chemical
p-Xylene-2-sulfonic Acid Hydrate >98.0%(HPLC)(T)
25g
$ 36.00

TCI Chemical
p-Xylene-2-sulfonic Acid Hydrate >98.0%(HPLC)(T)
100g
$ 141.00

Sigma-Aldrich
p-Xylene-2-sulfonic acid hydrate ≥98%
25g
$ 62.10

Crysdot
2,5-Dimethylbenzenesulfonicacid 98%
10g
$ 470.00

American Custom Chemicals Corporation
2,5-DIMETHYLBENZENESULFONIC ACID 95.00%
25G
$ 151.20

Alichem
2,5-Dimethylbenzenesulfonicacid
10g
$ 399.36

Alichem
2,5-Dimethylbenzenesulfonicacid
5g
$ 227.36

Alfa Aesar
2,5-Dimethylbenzenesulfonic acid hydrate, 99%
500g
$ 536.00

Alfa Aesar
2,5-Dimethylbenzenesulfonic acid hydrate, 99%
100g
$ 133.00

Alfa Aesar
2,5-Dimethylbenzenesulfonic acid hydrate, 99%
25g
$ 41.50

Total 47 raw suppliers

Chemical Property of 2,5-Dimethylbenzenesulfonic acid Edit

Chemical Property:

Appearance/Colour:Solid.
Vapor Pressure:4E-12mmHg at 25°C
Melting Point:86 ºC
Refractive Index:1.5081 (estimate)
Boiling Point:531.5°C at 760 mmHg
PKA:-0.47±0.30(Predicted)
Flash Point:275.2°C
PSA：62.75000
Density:1.3286 (rough estimate)
LogP:2.63090
Storage Temp.:2-8°C
Sensitive.:Hygroscopic
Water Solubility.:Soluble in water
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:186.03506535
Heavy Atom Count:12
Complexity:240

Purity/Quality:

97% ^*data from raw suppliers

p-Xylene-2-sulfonic Acid Hydrate >98.0%(HPLC)(T) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/38
Safety Statements: 26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=C(C=C1)C)S(=O)(=O)O
Uses Reagent for serum cholesterol determination.

Technology Process of 2,5-Dimethylbenzenesulfonic acid

There total 5 articles about 2,5-Dimethylbenzenesulfonic 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: 90.0%

: 106-42-3
para-xylene

: 609-54-1
2,5-dimethylbenzenesulfonic acid

Guidance literature:: With sodium hydrogensulfite; pyridinium chlorochromate; In neat (no solvent); at 100 ℃; for 0.0333333h; under 1500.15 Torr; Reagent/catalyst; Microwave irradiation;
DOI:10.1080/10426507.2020.1782909