2-Dodecylcyclohexane-1,4-dione

Base Information

Chemical Name:2-Dodecylcyclohexane-1,4-dione
CAS No.:105314-19-0
Molecular Formula:C18H32O2
Molecular Weight:280.451
Hs Code.:
DSSTox Substance ID:DTXSID40549084
Nikkaji Number:J1.058.009I
Mol file:105314-19-0.mol

Synonyms:2-DODECYLCYCLOHEXANE-1,4-DIONE;105314-19-0;SCHEMBL10603857;2-dodecyl-1,4-cyclohexane-dione;DTXSID40549084;CZFNHQLYRHMVSB-UHFFFAOYSA-N

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-Dodecylcyclohexane-1,4-dione

Chemical Property:

XLogP3:5.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:11
Exact Mass:280.240230259
Heavy Atom Count:20
Complexity:283

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCCC1CC(=O)CCC1=O

Technology Process of 2-Dodecylcyclohexane-1,4-dione

There total 1 articles about 2-Dodecylcyclohexane-1,4-dione 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: 45.0%

: 4292-19-7
1-Iodododecane

: 2785-98-0
2,5-dimethoxybenzoic acid

: 105314-19-0
2-n-dodecyl-1,4-cyclohexadione

Guidance literature:: 2,5-dimethoxybenzoic acid; With lithium; diethylamine; In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; at 10 - 15 ℃; ultrasonic irradiation;

1-Iodododecane; In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; for 1h;

With hydrogenchloride; In N,N,N,N,N,N-hexamethylphosphoric triamide; water; for 2.5h; pH=1; Heating;
DOI:10.1081/SCC-100103524

Reference yield: 73.0%

: 105314-19-0
2-n-dodecyl-1,4-cyclohexadione

: 109-77-3
malononitrile

: 105314-20-3
1,4-bis(dicyanomethylene)-2-n-dodecylcyclohexane

Guidance literature:: With 3-amino propanoic acid; In tetrahydrofuran; for 3h; Heating;
DOI:10.1021/jo00387a035

Reference yield: 64.0%

: 105314-19-0
2-n-dodecyl-1,4-cyclohexadione

: 109-77-3
malononitrile

: 105314-21-4
n-dodecyl-7,7,8,8-tetracyano-p-quinodimethane

Guidance literature:: 2-n-dodecyl-1,4-cyclohexadione; malononitrile; With 3-amino propanoic acid; In tetrahydrofuran; water; for 7h; Heating;

With N-Bromosuccinimide; In acetonitrile; for 0.5h;

With pyridine; In water; acetonitrile; for 0.166667h;
DOI:10.1081/SCC-100103524