2,5-Dimethylbenzenethiol

Base Information

Chemical Name:2,5-Dimethylbenzenethiol
CAS No.:4001-61-0
Molecular Formula:C8H10S
Molecular Weight:138.233
Hs Code.:29309090
European Community (EC) Number:223-649-3
UNII:2NV04MU9ER
DSSTox Substance ID:DTXSID3063259
Nikkaji Number:J155.602I
Wikidata:Q72472241
ChEMBL ID:CHEMBL1433856
Mol file:4001-61-0.mol

Synonyms:2,5-Dimethylthiophenol;2,5-Dimethylbenzenethiol;4001-61-0;Benzenethiol, 2,5-dimethyl-;2,5-Xylenethiol;2,5-dimethylbenzene-1-thiol;2,5-Dimethyl thiophenol;EINECS 223-649-3;MFCD00010020;2,5-dimethyl-benzenethiol;2NV04MU9ER;p-Xylenethiol;2-Mercapto-p-xylene;2,5dimethylthiophenol;2,5-dimethyl-thiophenol;2,5-Dimethyl-benzolthiol;UNII-2NV04MU9ER;2,5-Dimethylbenzenethiol #;SCHEMBL394229;CHEMBL1433856;DTXSID3063259;2,5-Dimethylbenzenethiol, 97%;AC9804;AKOS000120704;PS-5796;NCGC00189400-01;AC-10704;SY049369;D2393;FT-0610458;EN300-20977;2,5-Dimethylbenzenethiol, 90%, technical grade;W-106394

Suppliers and Price of 2,5-Dimethylbenzenethiol

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

AHH
2,5-Dimethylthiophenol 97%
500g
$ 355.00

AK Scientific
2,5-Dimethylthiophenol
100g
$ 212.00

AK Scientific
2,5-Dimethylthiophenol
25g
$ 104.00

Alfa Aesar
2,5-Dimethylthiophenol, 98%
5g
$ 47.70

Alfa Aesar
2,5-Dimethylthiophenol, 98%
25g
$ 148.00

Alfa Aesar
2,5-Dimethylthiophenol 98%
100g
$ 505.00

Alichem
2,5-Dimethylbenzenethiol
500g
$ 390.55

American Custom Chemicals Corporation
2,5-DIMETHYLTHIOPHENOL 95.00%
1G
$ 597.87

American Custom Chemicals Corporation
2,5-DIMETHYLTHIOPHENOL 95.00%
2.5G
$ 746.88

American Custom Chemicals Corporation
2,5-DIMETHYLTHIOPHENOL 95.00%
5G
$ 808.96

Total 70 raw suppliers

Chemical Property of 2,5-Dimethylbenzenethiol

Chemical Property:

Appearance/Colour:clear light yellow liquid
Vapor Pressure:0.366mmHg at 25°C
Melting Point:-30°C (estimate)
Refractive Index:n20/D 1.5698(lit.)
Boiling Point:205 °C at 760 mmHg
Flash Point:83 ºC
PSA：38.80000
Density:1.027 g/cm³
LogP:2.59210
Sensitive.:Stench
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:138.05032149
Heavy Atom Count:9
Complexity:90.6

Purity/Quality:

99% ^*data from raw suppliers

2,5-Dimethylthiophenol 97% ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=CC(=C(C=C1)C)S
Uses 2,5-Dimethylbenzenethiol was used in the synthesis of poly(2-dodecanoylsulfanyl-p-phenylenevinylene). It was also used in the synthesis of 1,1,2-trichloro-4-(2,5-dimethylphenylthio)-1-buten-3-yne; 1,1,2,4-tetrachloro-4-(2,5-dimethylphenylthio)-1,3-butadiene and 1,1,2-trichloro-4,4-bis(2,5-dimethylphenylthio)-1,3-butadiene.

Technology Process of 2,5-Dimethylbenzenethiol

There total 16 articles about 2,5-Dimethylbenzenethiol 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: 96.0%

: 571167-32-3
3-(2,5-dimethylphenyl)-sulfanyl-propionic acid methyl ester

: 4001-61-0
2,5-dimethylthiophenol

Guidance literature:: With potassium tert-butylate; In tetrahydrofuran; at -78 ℃; for 0.166667h;
DOI:10.1021/jo034013h

Reference yield: 90.0%

: 89816-82-0
2,5-dimethylphenyl ethyl xanthate

: 4001-61-0
2,5-dimethylthiophenol

Guidance literature:: With lithium aluminium tetrahydride; In diethyl ether; for 3h; Heating;

Reference yield: 82.0%

: 1122-42-5
2-iodo-p-xylene

: 4001-61-0
2,5-dimethylthiophenol

Guidance literature:: With copper(l) iodide; thiourea; L-proline; sodium t-butanolate; In dimethyl sulfoxide; at 90 ℃; for 24h; Inert atmosphere;
DOI:10.1002/cjoc.201090246