S-(4-methylphenyl) propanethioate

Base Information

Chemical Name:S-(4-methylphenyl) propanethioate
CAS No.:18241-63-9
Molecular Formula:C10H12 O S
Molecular Weight:180.271
Hs Code.:2930909090
DSSTox Substance ID:DTXSID60397645
Nikkaji Number:J1.317.468G
Wikidata:Q82199156
Mol file:18241-63-9.mol

Synonyms:18241-63-9;S-Propionyl-4-mercaptotoluene;S-(4-methylphenyl) propanethioate;S-p-Tolyl propanethioate;Propanethioic acid, S-(4-methylphenyl) ester;S-p-Tolylpropanethioate;S-(p-tolyl) propanethioate;S-propanyl-4-mercaptotoluene;SCHEMBL7514358;DTXSID60397645;AKOS006344202;Propanethioic acid,s-(4-methylphenyl)ester;FT-0637665;propanethioic acid S-(4-methylphenyl) ester;Thiopropanoic acid S-(4-methylphenyl) ester;A812696;J-011672

Suppliers and Price of S-(4-methylphenyl) propanethioate

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

American Custom Chemicals Corporation
S-PROPIONYL-4-MERCAPTOTOLUENE 95.00%
25G
$ 1336.38

American Custom Chemicals Corporation
S-PROPIONYL-4-MERCAPTOTOLUENE 95.00%
5G
$ 858.44

American Custom Chemicals Corporation
S-PROPIONYL-4-MERCAPTOTOLUENE 95.00%
1G
$ 606.61

AHH
S-Propionyl-4-mercaptotoluene 98%
25g
$ 430.00

Total 14 raw suppliers

Chemical Property of S-(4-methylphenyl) propanethioate

Chemical Property:

Vapor Pressure:2.87mmHg at 25°C
Boiling Point:272.9°Cat760mmHg
Flash Point:112.3°C
PSA：42.37000
Density:1.08g/cm³
LogP:3.02370
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:180.06088618
Heavy Atom Count:12
Complexity:148

Purity/Quality:

97% ^*data from raw suppliers

S-PROPIONYL-4-MERCAPTOTOLUENE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(=O)SC1=CC=C(C=C1)C

Technology Process of S-(4-methylphenyl) propanethioate

There total 9 articles about S-(4-methylphenyl) propanethioate 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%

: 79-03-8
propionyl chloride

: 106-45-6
para-thiocresol

: 18241-63-9
p-methylphenyl thiolmethylacetate

Guidance literature:: With tetrabutyl-ammonium chloride; sodium hydroxide; In dichloromethane; water; at 0 ℃; for 0.0833333h;
DOI:10.1080/10426501003713072

Reference yield: 93.0%

: 79-03-8
propionyl chloride

: 52403-06-2
p-tolylthiolatocopper(I)

: 18241-63-9
p-methylphenyl thiolmethylacetate

Guidance literature:: In diethyl ether; at 20 ℃; for 4h;
DOI:10.1016/S0040-4039(00)92877-6

Reference yield: 87.0%

: 103-19-5
di(p-tolyl) disulfide

: 123-62-6
propionic acid anhydride

: 18241-63-9
p-methylphenyl thiolmethylacetate

Guidance literature:: With [{Ti(salophen)H₂O}₂O][OSO₂C₄F₉]₂; zinc; In tetrahydrofuran; at 20 ℃; for 1.5h; Inert atmosphere;
DOI:10.1016/j.tet.2019.130750