Cyclohexyl ammonium benzoate

Base Information

• Chemical Name: Cyclohexyl ammonium benzoate
• CAS No.: 3129-92-8
• Molecular Formula: C13H19NO2
• Molecular Weight: 221.299
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID4062856
• Mol file: 3129-92-8.mol

Synonyms:cyclohexyl ammonium benzoate;SCHEMBL597061;(cyclohexylammonium).(benzoate);DTXSID4062856

Chemical Property of Cyclohexyl ammonium benzoate

Chemical Property:

• Vapor Pressure: 0.0122mmHg at 25°C
• Melting Point: 177 °C
• Boiling Point: 249.3 °C at 760 mmHg
• Flash Point: 111.4 °C
• PSA: 63.32000
• Density: 0.577[at 20℃]
• LogP: 3.23480
• Storage Temp.: 2-8°C
• Water Solubility.: 105g/L at 20℃
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 221.141578849
• Heavy Atom Count: 16
• Complexity: 144

Purity/Quality:

99.9% ^*data from raw suppliers

CyclohexylamineBenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)[NH3+].C1=CC=C(C=C1)C(=O)[O-]

Technology Process of Cyclohexyl ammonium benzoate

There total 1 articles about Cyclohexyl ammonium benzoate 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:

cyclohexylamine (108-91-8,157973-60-9) + benzoic acid (65-85-0,8013-63-6) → cyclohexylammonium benzoate (3129-92-8)

Guidance literature:

In methanol; Heating; Sonication;

DOI:10.1039/c0ce00749h

upstream raw materials:

cyclohexylamine

benzoic acid

Refernces