1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-YL]ethan-1-one

Base Information

Chemical Name:1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-YL]ethan-1-one
CAS No.:72928-23-5
Molecular Formula:C₁₄H₂₂O
Molecular Weight:206.328
Hs Code.:
European Community (EC) Number:277-057-5
DSSTox Substance ID:DTXSID50888310
Nikkaji Number:J296.395G
Mol file:72928-23-5.mol

Synonyms:72928-23-5;1-[4-METHYL-5-(3-METHYL-2-BUTENYL)-3-CYCLOHEXEN-1-YL]ETHAN-1-ONE;EINECS 277-057-5;2-(4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-yl)ethan-2-one;Ethanone, 1-(4-methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-yl)-;Ethanone, 1-[4-methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-yl]-;Ethanone, 1-(4-methyl-5-(3-methyl-2-buten-1-yl)-3-cyclohexen-1-yl)-;1-(4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-yl)ethan-1-one;Ethanone, 1-[4-methyl-5-(3-methyl-2-buten-1-yl)-3-cyclohexen-1-yl]-;DTXSID50888310;1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-yl]ethanone

Suppliers and Price of 1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-YL]ethan-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 3 raw suppliers

Chemical Property of 1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-YL]ethan-1-one

Chemical Property:

Vapor Pressure:0.00294mmHg at 25°C
Boiling Point:284.6°C at 760 mmHg
Flash Point:114.4°C
PSA：17.07000
Density:0.899g/cm³
LogP:3.90420
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:206.167065321
Heavy Atom Count:15
Complexity:293

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CCC(CC1CC=C(C)C)C(=O)C

Technology Process of 1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-YL]ethan-1-one

There total 3 articles about 1-[4-Methyl-5-(3-methyl-2-butenyl)-3-cyclohexen-1-YL]ethan-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:

: 3779-61-1,1856-63-9
trans ocimene

: 78-94-4,25038-87-3
methyl vinyl ketone

: 72928-23-5
methyl cis-4-methyl-5-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 72928-23-5
methyl trans-4-methyl-5-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 73019-21-3
methyl cis-3-methyl-2-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 73019-21-3
methyl trans-3-methyl-2-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

Guidance literature:: In xylene; at 110 - 120 ℃; for 72h; Yield given. Further byproducts given. Yields of byproduct given;
DOI:10.1002/hlca.19840670503

Reference yield:

: 3779-61-1,1856-63-9
trans ocimene

: 78-94-4,25038-87-3
methyl vinyl ketone

: 72928-23-5
methyl cis-4-methyl-5-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 72928-23-5
methyl trans-4-methyl-5-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 73019-21-3
methyl cis-3-methyl-2-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 73019-21-3
methyl trans-3-methyl-2-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

Guidance literature:: In xylene; at 110 - 120 ℃; for 72h; Yield given. Further byproducts given. Yields of byproduct given;
DOI:10.1002/hlca.19840670503

Reference yield:

: 72928-23-5
methyl cis-4-methyl-5-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

: 72928-23-5
methyl trans-4-methyl-5-(3'-methyl-2'-butenyl)-3-cyclohexenyl ketone

Guidance literature:: With potassium methanolate; In methanol; for 3h; Product distribution; Heating; equilibration;
DOI:10.1002/hlca.19840670503