1-Cycloheptyl-3-cyclohexylurea

Base Information

• Chemical Name: 1-Cycloheptyl-3-cyclohexylurea
• CAS No.: 1145-53-5
• Molecular Formula: C14H26N2O
• Molecular Weight: 238.373
• DSSTox Substance ID: DTXSID00357127
• Wikidata: Q82136877
• Pharos Ligand ID: H86P478PVAMJ
• ChEMBL ID: CHEMBL3661368
• Mol file: 1145-53-5.mol

Synonyms:1-cycloheptyl-3-cyclohexylurea;1145-53-5;N-cycloheptyl-N'-cyclohexylurea;Cambridge id 7271456;Oprea1_408080;CHEMBL3661368;SCHEMBL12196125;DTXSID00357127;BDBM129276;STK432690;AKOS003297292;US8815951, 22;AK-968/41926597

Chemical Property of 1-Cycloheptyl-3-cyclohexylurea

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 238.204513457
• Heavy Atom Count: 17
• Complexity: 228

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCC(CC1)NC(=O)NC2CCCCC2

Technology Process of 1-Cycloheptyl-3-cyclohexylurea

There total 2 articles about 1-Cycloheptyl-3-cyclohexylurea 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: 93.0%

cycloheptanamine (5452-35-7) + Cyclohexyl isocyanate (3173-53-3) → 1-Cycloheptyl-3-cyclohexyl-urea (1145-53-5)

Guidance literature:

In hexane; at 20 ℃;

DOI:10.1016/S0006-2952(02)00952-8

Reference yield:

→ 1-Cycloheptyl-3-cyclohexyl-urea (1145-53-5)

Guidance literature:

entspr. Amin, entspr. Isocyanat;

upstream raw materials:

cycloheptanamine

Cyclohexyl isocyanate

Refernces