N-butylcycloheptanamine

Base Information

• Chemical Name: N-butylcycloheptanamine
• CAS No.: 161012-67-5
• Molecular Formula: C₁₁H₂₃N
• Molecular Weight: 169.31
• DSSTox Substance ID: DTXSID50440659
• Nikkaji Number: J706.445D
• Wikidata: Q82257022
• Mol file: 161012-67-5.mol

Synonyms:N-butylcycloheptanamine;161012-67-5;N-butylcycloheptanamine x1HCl;N-Cycloheptylbutan-1-amine;SCHEMBL7775131;DTXSID50440659;AKOS000234487

Chemical Property of N-butylcycloheptanamine

Chemical Property:

• Vapor Pressure: 0.083mmHg at 25°C
• Boiling Point: 226.2±8.0 °C(Predicted)
• PKA: 11.23±0.20(Predicted)
• Density: 0.84±0.1 g/cm3(Predicted)
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 169.183049738
• Heavy Atom Count: 12
• Complexity: 93.2

Purity/Quality:

97% ^*data from raw suppliers

N-BUTYLCYCLOHEPTANAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCNC1CCCCCC1

Technology Process of N-butylcycloheptanamine

There total 1 articles about N-butylcycloheptanamine 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:

Butyl-cycloheptylidene-amine; compound with acetic acid → N-butylcycloheptanamine (161012-67-5)

Guidance literature:

With magnesium; acetic acid; In methanol; Yield given; 1.) reflux, 2 h, 2.) reflux, 1 h;

DOI:10.1039/P19960000265