2-Cyclohexylethylamine

Base Information

• Chemical Name: 2-Cyclohexylethylamine
• CAS No.: 4442-85-7
• Molecular Formula: C8H17N
• Molecular Weight: 127.23
• Hs Code.: 2921300090
• European Community (EC) Number: 224-673-7
• NSC Number: 59005,44879
• UNII: XWL8YSK9QV
• DSSTox Substance ID: DTXSID60196170
• Nikkaji Number: J49.881E
• Wikidata: Q72459928
• ChEMBL ID: CHEMBL19428
• Mol file: 4442-85-7.mol

Synonyms:2-cyclohexylethanamine;4442-85-7;2-Cyclohexylethylamine;2-Cyclohexyl-ethylamine;Cyclohexaneethanamine;Cyclohexaneethylamine;ETHYLAMINE, 2-CYCLOHEXYL-;2-Aminoethylcyclohexane;2-Cyclohexylethan-1-Amine;NSC 59005;WIN 5522-2;2-CYCLOHEXYL-ETHYLAMINE HYDROCHLORIDE;EINECS 224-673-7;NSC 44879;BRN 2689115;Cyclohexaneethanamine (9CI);CHEMBL19428;(2-Cyclohexylethyl)amine hydrochloride;NSC-44879;NSC-59005;WLN: L6TJ A2Z;4-12-00-00133 (Beilstein Handbook Reference);2-cyclohexylehylamine;2-Cyclohexyl ethylamine;XWL8YSK9QV;(2-Aminoethyl)cyclohexane;SCHEMBL79025;DTXSID60196170;Win-5522-2;BCP22978;NSC44879;NSC59005;2-cyclohexyl-ethylamine, AldrichCPR;BDBM50028627;MFCD00058668;AKOS000187805;AB02346;AS-18864;LS-68037;BB 0257418;C2765;FT-0683198;EN300-35782

Chemical Property of 2-Cyclohexylethylamine

Chemical Property:

• Vapor Pressure: 1.53mmHg at 25°C
• Melting Point: -15°C (estimate)
• Refractive Index: 1.4630-1.4670
• Boiling Point: 169.6°Cat760mmHg
• PKA: 10?+-.0.10(Predicted)
• Flash Point: 51°C
• PSA: 26.02000
• Density: 0.861g/cm³
• LogP: 2.61580
• Sensitive.: Air Sensitive
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 127.136099547
• Heavy Atom Count: 9
• Complexity: 65

Purity/Quality:

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

2-Cyclohexylethanamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-52-36
• Safety Statements: 26

MSDS Files:

Useful:

• Canonical SMILES: C1CCC(CC1)CCN
• Uses: In the resolution system of (RS)-1-cyclohexylethylamine (CHEA) with (S)-mandelic acid (MA), the DCR (dielectrically controlled resolution) phenomenon was clearly observed.

Technology Process of 2-Cyclohexylethylamine

There total 24 articles about 2-Cyclohexylethylamine 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: 80.0%

2-(cyclohexyl)ethylamide (1503-87-3) → 2-cyclohexylethylamine (4442-85-7)

Guidance literature:

2-(cyclohexyl)ethylamide; With bis(cyclopentadienyl)dihydrozirconium; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; at 100 ℃; for 36h; Glovebox; Inert atmosphere;

With hydrogenchloride; In diethyl ether; water; for 2h; Temperature; Glovebox; Inert atmosphere;

DOI:10.1016/S1872-2067(21)63853-6

Reference yield: 71.0%

vinylcyclohexane (695-12-5,25498-06-0) → 2-cyclohexylethylamine (4442-85-7)

Guidance literature:

vinylcyclohexane; With Schwartz's reagent; In tetrahydrofuran; at 25 ℃;

With hydroxylamine-O-sulfonic acid; In tetrahydrofuran; at 25 ℃; for 0.5h;

DOI:10.1021/jo401498w

Reference yield: 70.0%

2-(1-cyclohexenyl)ethylamine (3399-73-3) → 2-cyclohexylethylamine (4442-85-7)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; for 10h; under 10 - 15 Torr; Ambient temperature;

DOI:10.1007/BF00768385

upstream raw materials:

tyrosamine

1-bromo-2-cyclohexylethane

potassium phtalimide

2-cyclohexylacetonitrile

Downstream raw materials:

N,N-dimethylcyclohexylmethylamine

bis-(2-cyclohexyl-ethyl)-amine

(2-cyclohexyl-ethyl)-guanidine

4-(2-cyclohexyl-ethyl)-morpholine

Refernces

• 1、 Diler, Fatma,Burhan, Hakan,Genc, Hayriye,Kuyuldar, Esra,Zengin, Mustafa,Cellat, Kemal,Sen, Fatih. "Efficient preparation and application of monodisperse palladium loaded graphene oxide as a reusable and effective heterogeneous catalyst for suzuki cross-coupling reaction". . . Retrieved 2019/11/29.
• 2、 Zhang, Hongwei,Zhou, Yulu,Tian, Peiyuan,Jiang, Cuiyu. "Copper-Catalyzed Amide Radical-Directed Cyanation of Unactivated Csp3-H Bonds". . . Retrieved 2019/03/19.