6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one

Base Information

Chemical Name:6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one
CAS No.:79300-00-8
Molecular Formula:C12H18O2S2
Molecular Weight:258.40000
Hs Code.:
DSSTox Substance ID:DTXSID00508692
Wikidata:Q82365824

Synonyms:79300-00-8;DTXSID00508692;6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one

Suppliers and Price of 6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one

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

Total 1 raw suppliers

Chemical Property of 6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one

Chemical Property:

PSA：76.90000
LogP:3.59580
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:258.07482216
Heavy Atom Count:16
Complexity:324

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)OC1=CC(=O)C(=C(SC)SC)CC1

Technology Process of 6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one

There total 1 articles about 6-[Bis(methylsulfanyl)methylidene]-3-[(propan-2-yl)oxy]cyclohex-2-en-1-one 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:

: 75-15-0,12122-00-8
carbon disulfide

: 58529-72-9
3-isopropoxycyclohex-2-en-1-one

: 74-88-4
methyl iodide

: 79300-00-8
6-(Bis-methylsulfanyl-methylene)-3-isopropoxy-cyclohex-2-enone

Guidance literature:: With lithium diisopropyl amide; Yield given. Multistep reaction; LHMDS, THF, HMPT;
DOI:10.1021/jo00191a027

Reference yield: 78.0%

: 917-54-4
methyllithium

: 79300-00-8
6-(Bis-methylsulfanyl-methylene)-3-isopropoxy-cyclohex-2-enone

: 84308-10-1
3-Isopropoxy-6-[1-methylsulfanyl-eth-(Z)-ylidene]-cyclohex-2-enone

: 84308-09-8
3-Isopropoxy-6-[1-methylsulfanyl-eth-(E)-ylidene]-cyclohex-2-enone

Guidance literature:: With copper(l) iodide; n-butyllithium; thiophenol; 1.) THF_. 0 deg, 10 min, 2.) 0 deg C, 15 min, 3.) -78 deg C, 1 h, 4.) THF, -78 deg C,45 min, then up to -40 deg C within 15 min;
DOI:10.1021/ja00302a014