1-[2-(2-Phenylethynyl)cyclohexen-1-yl]naphthalene

Base Information

• Chemical Name: 1-[2-(2-Phenylethynyl)cyclohexen-1-yl]naphthalene
• CAS No.: 60955-64-8
• Molecular Formula: C24H20
• Molecular Weight: 308.41600
• DSSTox Substance ID: DTXSID10365051
• Wikidata: Q82149415
• Mol file: 60955-64-8.mol

Synonyms:1-[2-(2-phenylethynyl)cyclohexen-1-yl]naphthalene;60955-64-8;1-[2-(phenylethynyl)-1-cyclohexen-1-yl]naphthalene;AB-131/42301531;DTXSID10365051

Chemical Property of 1-[2-(2-Phenylethynyl)cyclohexen-1-yl]naphthalene

Chemical Property:

• PSA: 0.00000
• LogP: 6.21910
• XLogP3: 6.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 308.156500638
• Heavy Atom Count: 24
• Complexity: 519

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(=C(C1)C#CC2=CC=CC=C2)C3=CC=CC4=CC=CC=C43

Technology Process of 1-[2-(2-Phenylethynyl)cyclohexen-1-yl]naphthalene

There total 3 articles about 1-[2-(2-Phenylethynyl)cyclohexen-1-yl]naphthalene 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-Bromonaphthalene (90-11-9) → 1-(1-Naphthyl)-2-phenethinylcyclohexen (60955-64-8)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) Mg, Et₂O, (ii) /BRN= 774100/

2: (i) PhLi, Et₂O, (ii) /BRN= 2053999/

DOI:10.1039/P29760001104

Reference yield:

2-Chlorocyclohexanone (822-87-7) → 1-(1-Naphthyl)-2-phenethinylcyclohexen (60955-64-8)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) Mg, Et₂O, (ii) /BRN= 774100/

2: (i) PhLi, Et₂O, (ii) /BRN= 2053999/

DOI:10.1039/P29760001104

Reference yield:

2-(naphthalen-1-yl)cyclohexanone (22591-15-7) + phenylacetylene (536-74-3) → 1-(1-Naphthyl)-2-phenethinylcyclohexen (60955-64-8)

Guidance literature:

Multistep reaction; (i) PhLi, Et₂O, (ii) /BRN= 2053999/;

DOI:10.1039/P29760001104

upstream raw materials:

2-(naphthalen-1-yl)cyclohexanone

phenylacetylene

1-Bromonaphthalene

2-Chlorocyclohexanone

Downstream raw materials:

6-Phenyl-1,2,3,4-tetrahydro-benzo[c]phenanthrene