2-Pentanone, 4-methyl-4-(methylthio)-

Base Information

Chemical Name:2-Pentanone, 4-methyl-4-(methylthio)-
CAS No.:23550-40-5
Molecular Formula:C7H14OS
Molecular Weight:146.254
Hs Code.:29309090
European Community (EC) Number:245-727-6
UNII:G69HK72Q3Y
DSSTox Substance ID:DTXSID0066905
Metabolomics Workbench ID:47841
Nikkaji Number:J228.994F
Wikidata:Q27278835
Mol file:23550-40-5.mol

Synonyms:23550-40-5;4-Methylthio-4-methyl-2-pentanone;2-Pentanone, 4-methyl-4-(methylthio)-;4-Methyl-4-(methylthio)-2-pentanone;4-Methyl-4-Methylthio-2-Pentanone;4-Methyl-4-(methylthio)pentan-2-one;4-methyl-4-methylsulfanylpentan-2-one;cassis pentanone;4-(Methylthio)-4-methyl-2-pentanone;FEMA No. 3376;4-Methylmercapto-4-methylpentan-2-one;G69HK72Q3Y;MFCD00049253;UNII-G69HK72Q3Y;Corps Cassis;EINECS 245-727-6;4-methyl-4-methylsulfanyl-pentan-2-one;SCHEMBL996119;DTXSID0066905;FEMA 3376;CHEBI:173384;4-methyl-4-methylsulanylpentan-2-one;AKOS015899811;4-met hylmercapto-4-methylpentan-2-one;4-methyl-4-(methylsulfanyl)pentan-2-one;LS-13332;SY101078;CS-0199050;FT-0616807;M3272;NS00021899;D95281;4-METHYLTHIO-4-METHYL-2-PENTANONE [FHFI];4-Methylthio-4-methyl-2-pentanone, >=98%, FG;A816766;Q-100302;Q27278835

Suppliers and Price of 2-Pentanone, 4-methyl-4-(methylthio)-

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

TCI Chemical
4-Methyl-4-methylthio-2-pentanone
25G
$ 48.00

TCI Chemical
4-Methyl-4-methylthio-2-pentanone
100G
$ 141.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
25 g
$ 71.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
25g-k
$ 71.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%,FG
1 SAMPLE-K
$ 50.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
sample-k
$ 50.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
100 g
$ 157.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
100g-k
$ 157.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
1 kg
$ 959.00

Sigma-Aldrich
4-Methylthio-4-methyl-2-pentanone ≥98%, FG
1kg-k
$ 929.00

Total 81 raw suppliers

Chemical Property of 2-Pentanone, 4-methyl-4-(methylthio)-

Chemical Property:

Vapor Pressure:0.293mmHg at 25°C
Refractive Index:n20/D 1.472(lit.)
Boiling Point:202.4 °C at 760 mmHg
Flash Point:73.5 °C
PSA：42.37000
Density:0.942 g/cm³
LogP:2.10710
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:146.07653624
Heavy Atom Count:9
Complexity:108

Purity/Quality:

99% ^*data from raw suppliers

4-Methyl-4-methylthio-2-pentanone ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(=O)CC(C)(C)SC
Description Prepared from mesityl oxide by addition of methyl sulfide; from acetone and methyl-6w(methylthio)aluminum.

Technology Process of 2-Pentanone, 4-methyl-4-(methylthio)-

There total 8 articles about 2-Pentanone, 4-methyl-4-(methylthio)- 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:

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 67-64-1
acetone

: 5188-07-8
sodium thiomethoxide

: 34047-39-7
4-methylsulfanyl-2-butanone

: 23550-40-5
4-methyl-4-methylthio-2-pentanone

: 219296-15-8
1,1-bis(methylsulfanylmethyl)propan-2-one

: 4-methyl-5-(methylthiomethyl)-7-thiabicyclo<3.3.1>non-3-en-2-one

Guidance literature:: With sodium sulfide; sodium hydroxide; sodium thioethylate; at 20 ℃; Further byproducts given;

Reference yield:

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 67-64-1
acetone

: 5188-07-8
sodium thiomethoxide

: 34047-39-7
4-methylsulfanyl-2-butanone

: 23550-40-5
4-methyl-4-methylthio-2-pentanone

: 3-methyl-4-methylthiomethyl-2-cyclohexen-1-one

: 4-methyl-5-(methylthiomethyl)-7-thiabicyclo<3.3.1>non-3-en-2-one

Guidance literature:: With sodium sulfide; sodium hydroxide; sodium thioethylate; at 20 ℃; Further byproducts given;

Reference yield:

: 6156-18-9
2,2-bis(methylthio)propane

: 67-64-1
acetone

: 108-95-2,27073-41-2
phenol

: 80-05-7
BPA

: 287110-79-6
C₂₇H₃₀O₃

: 74-93-1
methylthiol

: 7559-72-0
2,2-bis(2-hydroxyphenyl)-propane

: 10527-11-4
5-hydroxy-3-(4-hydroxyphenyl)-1,1,3-trimethylindane

: 2300-15-4
2,4-bis[1-(4-hydroxyphenyl)-1-methylethyl]phenol

: 23550-40-5
4-methyl-4-methylthio-2-pentanone

: 837-08-1
2-[1-(4-hydroxyphenyl)-1-methylethyl]-phenol

: 109252-41-7
5-hydroxy-1-(4'-hydroxyphenyl)-1,3,3-trimethylindan

Guidance literature:: strongly acidic 2percent cross linked sulfonated styrene divinylbenzene cationic gel exchange resin CT₁₂₂; In water; at 75 ℃; for 3h; Product distribution / selectivity;