2,7-Dibenzylcycloheptanone

Base Information

• Chemical Name: 2,7-Dibenzylcycloheptanone
• CAS No.: 49709-10-6
• Molecular Formula: C21H24O
• Molecular Weight: 292.4147
• DSSTox Substance ID: DTXSID40964359
• Mol file: 49709-10-6.mol

Synonyms:2,7-Dibenzylcycloheptanone;2,7-Bis(phenylmethyl)cycloheptanone;Cycloheptanone, 2,7-bis(phenylmethyl)-;49709-10-6;C21H24O;2,7-dibenzylcycloheptan-1-one;DTXSID40964359

Chemical Property of 2,7-Dibenzylcycloheptanone

Chemical Property:

• Vapor Pressure: 9.3E-08mmHg at 25°C
• Boiling Point: 434.7°C at 760 mmHg
• Flash Point: 188.3°C
• Density: 1.054g/cm³
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 292.182715385
• Heavy Atom Count: 22
• Complexity: 304

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C(=O)C(C1)CC2=CC=CC=C2)CC3=CC=CC=C3

Technology Process of 2,7-Dibenzylcycloheptanone

There total 5 articles about 2,7-Dibenzylcycloheptanone 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:

2,7-dibenzylidenecycloheptanone (899-98-9) → 2,7-dibenzylcycloheptanone (49709-10-6)

Guidance literature:

With ethanol; nickel; at 75 ℃; Hydrogenation;

Reference yield:

octane-1,8-dioic acid (505-48-6) → 2,7-dibenzylcycloheptanone (49709-10-6)

Guidance literature:

Multi-step reaction with 3 steps

1: iron-powder; Ba(OH)2

2: methanol. sodium methylate / 60 - 65 °C

3: ethanol; nickel / 75 °C / Hydrogenation

With barium dihydroxide; ethanol; sodium methylate; iron; nickel;

Reference yield:

cycloheptanone (502-42-1) → 2,7-dibenzylcycloheptanone (49709-10-6)

Guidance literature:

Multi-step reaction with 2 steps

1: methanol. sodium methylate / 60 - 65 °C

2: ethanol; nickel / 75 °C / Hydrogenation

With ethanol; sodium methylate; nickel;

upstream raw materials:

2,7-dibenzylidenecycloheptanone

ethanol

octane-1,8-dioic acid

cycloheptanone

Downstream raw materials:

2,7-dibenzyl-cycloheptanone oxime