N-Ethyldicyclohexylamine

Base Information

• Chemical Name: N-Ethyldicyclohexylamine
• CAS No.: 7175-49-7
• Molecular Formula: C14H27N
• Molecular Weight: 209.375
• Hs Code.: 29213099
• European Community (EC) Number: 230-534-1
• NSC Number: 221147
• UNII: 9A5D20NJX6
• DSSTox Substance ID: DTXSID6064585
• Nikkaji Number: J42.224J
• Wikidata: Q72474281
• Mol file: 7175-49-7.mol

Synonyms:N-Ethyldicyclohexylamine;7175-49-7;N-Cyclohexyl-N-ethylcyclohexanamine;Ethyldicyclohexylamine;Cyclohexanamine, N-cyclohexyl-N-ethyl-;dicyclohexylethylamine;DICYCLOHEXYLAMINE, N-ETHYL-;N-Cyclohexyl-N-ethylcyclohexylamine;EINECS 230-534-1;NSC 221147;BRN 2240256;9A5D20NJX6;NSC-221147;NSC221147;ethyl-dicyclohexylamine;UNII-9A5D20NJX6;SCHEMBL23038;N-Ethyldicyclohexylamine, 96%;DTXSID6064585;ADAL1186402;MFCD00003846;N-Cyclohexyl-N-ethylcyclohexanamine #;AKOS016014071;LS-61774;FT-0636382;A866375

Chemical Property of N-Ethyldicyclohexylamine

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 0.00507mmHg at 25°C
• Refractive Index: n20/D 1.485(lit.)
• Boiling Point: 275.5 °C at 760 mmHg
• PKA: 11.11±0.20(Predicted)
• Flash Point: 110.1 °C
• PSA: 3.24000
• Density: 0.91 g/cm³
• LogP: 3.97370
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 209.214349865
• Heavy Atom Count: 15
• Complexity: 148

Purity/Quality:

99% ^*data from raw suppliers

N-Ethyldicyclohexylamine 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCN(C1CCCCC1)C2CCCCC2
• Uses: N-Ethyldicyclohexylamine was used in the synthesis of F-amines along with other products by undergoing incomplete fluorination and fragmentation reactions.

Technology Process of N-Ethyldicyclohexylamine

There total 7 articles about N-Ethyldicyclohexylamine 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: 95.0%

C14H27NO → N,N-dicyclohexyl-N-ethylamine (7175-49-7)

Guidance literature:

With phenylboronic acid; In 1,2-dichloro-ethane; at 80 ℃; for 0.416667h;

DOI:10.1016/j.tetlet.2017.01.051

Reference yield: 10.0%

ethyl iodide (75-03-6) + N-cyclohexyl-cyclohexanamine (101-83-7) → N,N-dicyclohexyl-N-ethylamine (7175-49-7)

Guidance literature:

With potassium carbonate; In acetonitrile; at 80 ℃; for 16h;

DOI:10.1021/ja500031m

Reference yield:

acetic acid (64-19-7,77671-22-8) + N-ethyl-N-phenylamine (103-69-5) → N-ethyl-cyclohexanamine (5459-93-8) + N,N-dicyclohexyl-N-ethylamine (7175-49-7)

Guidance literature:

at 80 ℃; under 2280 Torr;

upstream raw materials:

N-formylethylamine

cyclohexanone

N-ethyl-N-phenylamine

diethyl sulfate

Downstream raw materials:

-butyl vinyl ether

(4-nitrophenyl)ethanone

1,1,3,3-tetrabenzoylpropane

[Ph2B(CH2PPh2)2]Pd(N,C:η2-NCy2CHCH3)

Refernces

• 1、 Senaweera, Sameera M.,Singh, Anuradha,Weaver, Jimmie D.. "Photocatalytic hydrodefluorination: Facile access to partially fluorinated aromatics". supporting information. p. 3002 - 3005. Retrieved 2014/03/21.