Cyclohexanamine, 1-(2-thienyl)-

Base Information

• Chemical Name: Cyclohexanamine, 1-(2-thienyl)-
• CAS No.: 100133-00-4
• Molecular Formula: C10H15NS
• Molecular Weight: 181.302
• European Community (EC) Number: 831-560-1
• DSSTox Substance ID: DTXSID20356233
• Nikkaji Number: J294.343C
• Wikidata: Q82135479
• ChEMBL ID: CHEMBL252936
• Mol file: 100133-00-4.mol

Synonyms:100133-00-4;Cyclohexanamine, 1-(2-thienyl)-;1-(thiophen-2-yl)cyclohexan-1-amine;1-thiophen-2-ylcyclohexan-1-amine;1-(2-thienyl)-cyclohexylamine;CHEMBL252936;SCHEMBL2685822;DTXSID20356233;UJIKDMHWQDKDPV-UHFFFAOYSA-N;AKOS010335854;CS-0262306;EN300-82072;Z756109996

Chemical Property of Cyclohexanamine, 1-(2-thienyl)-

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 181.09252066
• Heavy Atom Count: 12
• Complexity: 152

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C2=CC=CS2)N

Technology Process of Cyclohexanamine, 1-(2-thienyl)-

There total 5 articles about Cyclohexanamine, 1-(2-thienyl)- 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:

1-azido-1-(2-thienyl)cyclohexane (139401-06-2) → 1-(2-thienyl)cyclohexylamine (100133-00-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 3h; Yield given;

DOI:10.1021/jm00167a027

Reference yield:

2-(1-hydroxycyclohexyl)thiophene (17138-80-6) → 1-(2-thienyl)cyclohexylamine (100133-00-4)

Guidance literature:

Multi-step reaction with 2 steps

1: NaN₃, trichloroacetic acid / CHCl₃ / 24 h / -15 °C

2: Raney Ni / propan-2-ol / 0.5 h / 60 °C

With sodium azide; trichloroacetic acid; nickel; In chloroform; isopropyl alcohol;

DOI:10.1016/0223-5234(96)88257-2

Reference yield:

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 1-(2-thienyl)cyclohexylamine (100133-00-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 1.) Mg / 1.) ether, reflux, 3 h, 2.) ether, reflux, 16 h

2: NaN₃, trichloroacetic acid / CHCl₃ / 24 h / -15 °C

3: Raney Ni / propan-2-ol / 0.5 h / 60 °C

With sodium azide; magnesium; trichloroacetic acid; nickel; In chloroform; isopropyl alcohol;

DOI:10.1016/0223-5234(96)88257-2

upstream raw materials:

1-azido-1-(2-thienyl)cyclohexane

2-(1-hydroxycyclohexyl)thiophene

cyclohexanone