3,5-Dimethyl-2-cyclohexen-1-one

Base Information Edit

Chemical Name:3,5-Dimethyl-2-cyclohexen-1-one
CAS No.:1123-09-7
Molecular Formula:C8H12 O
Molecular Weight:124.183
Hs Code.:2914299000
European Community (EC) Number:214-369-2
NSC Number:10113,845
DSSTox Substance ID:DTXSID20870848
Nikkaji Number:J112.662H
Mol file:1123-09-7.mol

Synonyms:3,5-Dimethyl-2-cyclohexen-1-one;1123-09-7;3,5-Dimethylcyclohex-2-en-1-one;2-Cyclohexen-1-one, 3,5-dimethyl-;EINECS 214-369-2;AI3-21772;2-Cyclohexen-1-one,5-dimethyl-;NSC845;3,5-Dimethyl-2-cyclohexene-1-one;3,5-dimethylcyclohexenone;3,5-dimethyl-2-cyclohexenone;SCHEMBL1042381;DTXSID20870848;NSC 845;NSC-845;BAA12309;NSC10113;3,5-dimethyl-cyclohex-2-en-1-one;MFCD00001583;NSC 10113;NSC-10113;AKOS015917649;BS-52097;3,5-Dimethyl-2-cyclohexen-1-one, 98%;CS-0218032;FT-0658302;EN300-98240;E78362;A802550;J-002748

Suppliers and Price of 3,5-Dimethyl-2-cyclohexen-1-one

Supply Marketing:Edit

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

TRC
3,5-Dimethyl-2-cyclohexen-1-one
2.5g
$ 140.00

Sigma-Aldrich
3,5-Dimethyl-2-cyclohexen-1-one 98%
5g
$ 53.30

Total 16 raw suppliers

Chemical Property of 3,5-Dimethyl-2-cyclohexen-1-one Edit

Chemical Property:

Appearance/Colour:Clear colorless to very faint yellow liquid. Ketone odor.
Vapor Pressure:0.213mmHg at 25°C
Melting Point:166 °C(Solv: ethanol (64-17-5))
Refractive Index:n20/D 1.483(lit.)
Boiling Point:211-212 ºC
Flash Point:79 ºC
PSA：17.07000
Density:0.881
LogP:1.93170
XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:124.088815002
Heavy Atom Count:9
Complexity:156

Purity/Quality:

98%,99%, ^*data from raw suppliers

3,5-Dimethyl-2-cyclohexen-1-one ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 36-20/21/22
Safety Statements: 36/37/39-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1CC(=CC(=O)C1)C
Uses 3,5-Dimethyl-2-cyclohexen-1-one can be used as a starting material for the synthesis of the intermediate 3,5-dimethyl-2-cyclohexen-1-one.

Technology Process of 3,5-Dimethyl-2-cyclohexen-1-one

There total 57 articles about 3,5-Dimethyl-2-cyclohexen-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: 91.0%

: 874-63-5
3,5-dimethylmethoxybenzene

: 1123-09-7
3,5-dimethyl-2-cyclohexen-1-one

: 108-68-9,50356-23-5
3,5-Dimethylphenol

Guidance literature:: With N,N,N,N,N,N-hexamethylphosphoric triamide; lithium; In tetrahydrofuran; ethanol; at -30 ℃; for 2h;

Reference yield: 83.0%

: 141-97-9
ethyl acetoacetate

: 75-07-0,9002-91-9
acetaldehyde

: 1123-09-7
3,5-dimethyl-2-cyclohexen-1-one

Guidance literature:: ethyl acetoacetate; acetaldehyde; With piperazine; microwave irradiation;

With sulfuric acid; acetic acid; Further stages.; microwave irradiation;