1-(2-Ethylbutyl)cyclohexanecarbonyl chloride

Base Information

Chemical Name:1-(2-Ethylbutyl)cyclohexanecarbonyl chloride
CAS No.:211515-46-7
Molecular Formula:C13H23ClO
Molecular Weight:230.778
Hs Code.:
European Community (EC) Number:619-547-7
DSSTox Substance ID:DTXSID901257508
Mol file:211515-46-7.mol

Synonyms:1-(2-ethylbutyl)cyclohexanecarbonyl chloride;211515-46-7;1-(2-ethylbutyl)cyclohexane-1-carbonyl Chloride;EC 619-547-7;SCHEMBL1534074;LAMMLENPKIOKSX-UHFFFAOYSA-N;DTXSID901257508;1-(2-ethyl-butyl)-cyclohexanecarbonyl chloride

Suppliers and Price of 1-(2-Ethylbutyl)cyclohexanecarbonyl chloride

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 4 raw suppliers

Chemical Property of 1-(2-Ethylbutyl)cyclohexanecarbonyl chloride

Chemical Property:

Boiling Point:280.1±9.0 °C(Predicted)
PSA：17.07000
Density:0.982±0.06 g/cm3(Predicted)
LogP:4.52860
XLogP3:5.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:230.1437430
Heavy Atom Count:15
Complexity:203

Purity/Quality:: 99.9% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC(CC)CC1(CCCCC1)C(=O)Cl

Technology Process of 1-(2-Ethylbutyl)cyclohexanecarbonyl chloride

There total 5 articles about 1-(2-Ethylbutyl)cyclohexanecarbonyl chloride 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: 100.0%

: 381209-09-2
1-(2-ethyl-butyl)-cyclohexanecarboxylic acid

: 211515-46-7
1-(2-ethyl-butyl)-cyclohexanecarbonyl chloride

Guidance literature:: With thionyl chloride; triethylamine; at 41 - 55 ℃; for 1.13333 - 2.03333h; Product distribution / selectivity;

Reference yield:

: 3814-34-4
2-ethyl-1-bromobutane

: 211515-46-7
1-(2-ethyl-butyl)-cyclohexanecarbonyl chloride

Guidance literature:: Multi-step reaction with 2 steps

1.1: LDA / tetrahydrofuran / 1.5 h / 20 °C

1.2: tetrahydrofuran / 20 °C

2.1: 38 percent / oxalyl chloride / CH₂Cl₂ / 1 h / 20 °C

With oxalyl dichloride; lithium diisopropyl amide; In tetrahydrofuran; dichloromethane; 1.1: Metallation / 1.2: Alkylation / 2.1: Chlorination;
DOI:10.1021/jm000224s

Reference yield:

: 98-89-5
Cyclohexanecarboxylic acid

: 211515-46-7
1-(2-ethyl-butyl)-cyclohexanecarbonyl chloride

Guidance literature:: Multi-step reaction with 2 steps

1.1: LDA / tetrahydrofuran / 1.5 h / 20 °C

1.2: tetrahydrofuran / 20 °C

2.1: 38 percent / oxalyl chloride / CH₂Cl₂ / 1 h / 20 °C

With oxalyl dichloride; lithium diisopropyl amide; In tetrahydrofuran; dichloromethane; 1.1: Metallation / 1.2: Alkylation / 2.1: Chlorination;
DOI:10.1021/jm000224s