Cyclohexanemethylamine

Base Information

• Chemical Name: Cyclohexanemethylamine
• CAS No.: 3218-02-8
• Molecular Formula: C7H15N
• Molecular Weight: 113.203
• Hs Code.: 29213099
• European Community (EC) Number: 221-741-8
• NSC Number: 172991
• DSSTox Substance ID: DTXSID10185958
• Nikkaji Number: J48.566G
• Wikidata: Q62062411
• ChEMBL ID: CHEMBL1049
• Mol file: 3218-02-8.mol

Synonyms:Cyclohexanemethylamine;Cyclohexylmethanamine;3218-02-8;(Aminomethyl)cyclohexane;Aminomethylcyclohexane;Cyclohexanemethanamine;1-Cyclohexylmethanamine;1-cyclohexylmethylamine;Hexahydrobenzylamine;C-Cyclohexyl-methylamine;CHEMBL1049;EINECS 221-741-8;MFCD00001520;NSC 172991;BRN 0635751;cyclohexane methylamine;4-aminomethylcyclohexane;1tng;Cyclohexanemethyamine;cyclohexylmethyl amine;cyclohexanemethylamirie;aminomethyl-cyclohexane;cyclohexanemethyl amine;(cyclohexyl)methylamine;(cyclohexylmethyl)amine;5-cyclohexanemethylamine;cyclohexane methyl amine;D06FHW;SCHEMBL9465;NCIStruc1_000612;NCIStruc2_000445;Cyclohexanemethylamine, 98%;c-C6H11CH2NH2;DTXSID10185958;BDBM50113829;NSC172991;STL167338;AKOS000264296;CCG-357892;FD10556;NSC-172991;AM803690;BP-10455;BP-21486;LS-56924;SY001137;TS-01576;A1114;BB 0218099;CS-0015361;FT-0604860;EN300-19616;4-12-00-00123 (Beilstein Handbook Reference);J-018670;Q62062411;F2190-0505

Chemical Property of Cyclohexanemethylamine

Chemical Property:

• Appearance/Colour: Clear colorless to slightly yellow liquid
• Vapor Pressure: 4.73mmHg at 25°C
• Melting Point: -8 °C
• Refractive Index: n20/D 1.462(lit.)
• Boiling Point: 146 °C at 760 mmHg
• PKA: 10.42±0.29(Predicted)
• Flash Point: 43.3 °C
• PSA: 26.02000
• Density: 0.863 g/cm³
• LogP: 2.22570
• Sensitive.: Air Sensitive
• Water Solubility.: Slightly soluble in water.
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 113.120449483
• Heavy Atom Count: 8
• Complexity: 55.4

Purity/Quality:

99% ^*data from raw suppliers

Aminomethylcyclohexane >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 10-34
• Safety Statements: 16-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)CN
• Uses: Cyclohexanemethylamine was used in the synthesis of Schiff′s base ligand, 4-methyl-2,6-bis(cyclohexylmethyliminomethyl)-phenol, which forms hexanuclear zinc(II) complexes. Cyclohexanemethylamine was used during the synthesis of 1-acyl-4 cycloalkyl/arylsemicarbazides and 1-acyl-5-benzyloxy/hydroxyl carbamoylcarbazides from the nonsteroidal anti-inflammatory drugs.

Technology Process of Cyclohexanemethylamine

There total 56 articles about Cyclohexanemethylamine 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: 99.0%

cyclohexane carbonitrile (766-05-2) → cyclohexylmethylamine (3218-02-8)

Guidance literature:

With [Ru(H)(BH₄)(CO)(PPh₃)(3-(di-tert-butylphosphino)-N-((1-methyl-1H-imidazol-2 yl)methyl)propylamine)]; hydrogen; In isopropyl alcohol; at 70 ℃; for 3h; Inert atmosphere; Autoclave;

DOI:10.1002/chem.201504709

Reference yield: 94.0%

N-(cyclohexylmethyl)-4-methylbenzenesulfonamide (86328-85-0) → cyclohexylmethylamine (3218-02-8)

Guidance literature:

N-(cyclohexylmethyl)-4-methylbenzenesulfonamide; With n-butyllithium; In tetrahydrofuran; at 0 ℃;

With naphthalene; lithium; In tetrahydrofuran; at -78 - 20 ℃;

DOI:10.1016/j.tetlet.2009.11.009

Reference yield: 91.0%

cyclohexylcarboxamide (1122-56-1) → cyclohexylmethylamine (3218-02-8) + cyclohexylmethyl alcohol (100-49-2)

Guidance literature:

With hydrogen; at 160 ℃; under 75007.5 Torr;

DOI:10.1016/j.jcat.2010.12.009

upstream raw materials:

cyclohexylmethylene diacetate

Cyclohexylacetic acid

cyclohexylmethylcarbamic acid methyl ester

benzylamine hydrochloride

Downstream raw materials:

N-cyclohexylmethyl-N'-phenyl-urea

N-cyclohexylmethyl-acetamide

C₁₈H₂₆Cl₂N₂

Thiosulfuric acid S-(N-cyclohexylmethyl-carbamimidoylmethyl) ester

Refernces

• 1、 Cao, Yanwei,Zheng, Huan,Zhu, Gangli,Wu, Haihong,He, Lin. "Ceria supported Ru0-Ruδ+ clusters as efficient catalyst for arenes hydrogenation". supporting information. p. 770 - 774. Retrieved 2020/08/24.
• 2、 Hernandez, Willinton Y.,Kusema, Bright T.,Pennetier, Alex,Streiff, Stéphane. "Efficient hydrogenation of aliphatic amides to amines over vanadium-modified rhodium supported catalyst". . . Retrieved 2021/08/19.