3-n-Nonyl-2-cyclohexenone

Base Information

• Chemical Name: 3-n-Nonyl-2-cyclohexenone
• CAS No.: 137081-63-1
• Molecular Formula: C₁₅H₂₆O
• Molecular Weight: 222.371
• DSSTox Substance ID: DTXSID001311503
• Mol file: 137081-63-1.mol

Synonyms:3-n-nonyl-2-cyclohexenone;3-Nonyl-2-cyclohexen-1-one;DTXSID001311503;AKOS014505702;137081-63-1

Chemical Property of 3-n-Nonyl-2-cyclohexenone

Chemical Property:

• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 222.198365449
• Heavy Atom Count: 16
• Complexity: 228

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCC1=CC(=O)CCC1

Technology Process of 3-n-Nonyl-2-cyclohexenone

There total 3 articles about 3-n-Nonyl-2-cyclohexenone 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-nonyl-cyclohex-2-enol → 3-nonyl-cyclohex-2-enone (137081-63-1)

Guidance literature:

With chromium trioxide-pyridine complex; In dichloromethane; at 20 ℃; for 12h;

DOI:10.1271/bbb.68.2398

Reference yield:

cyclohexenone (930-68-7) → 3-nonyl-cyclohex-2-enone (137081-63-1)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran / 12 h / 20 °C

2: CrO₃-pyridine complex / CH₂Cl₂ / 12 h / 20 °C

With chromium trioxide-pyridine complex; In tetrahydrofuran; dichloromethane;

DOI:10.1271/bbb.68.2398

Reference yield:

nonylmagnesium bromide (39691-62-8) → 3-nonyl-cyclohex-2-enone (137081-63-1)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran / 12 h / 20 °C

2: CrO₃-pyridine complex / CH₂Cl₂ / 12 h / 20 °C

With chromium trioxide-pyridine complex; In tetrahydrofuran; dichloromethane;

DOI:10.1271/bbb.68.2398

upstream raw materials:

cyclohexenone

nonylmagnesium bromide

Downstream raw materials:

3-n-nonylphenol

Refernces