Ovalene

Base Information

• Chemical Name: Ovalene
• CAS No.: 190-26-1
• Molecular Formula: C32H14
• Molecular Weight: 398.463
• Hs Code.: 2901299090
• European Community (EC) Number: 205-880-1
• NSC Number: 91578
• UNII: 3M1901484G
• DSSTox Substance ID: DTXSID90172447
• Nikkaji Number: J145.956B
• Wikipedia: Ovalene
• Wikidata: Q2122603
• Metabolomics Workbench ID: 54815
• Mol file: 190-26-1.mol

Synonyms:Ovalene;190-26-1;UNII-3M1901484G;EINECS 205-880-1;NSC 91578;NSC-91578;3M1901484G;CHEBI:33091;DTXSID90172447;NSC91578;phenanthro[3,4,5,6-qrabc]coronene;C32H14;C32-H14;FT-0727007

Chemical Property of Ovalene

Chemical Property:

• Refractive Index: 1.4690 (estimate)
• Boiling Point: 456.64°C (rough estimate)
• PSA: 0.00000
• Density: 1.61g/cm³
• LogP: 9.25440
• XLogP3: 10
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 398.109550447
• Heavy Atom Count: 32
• Complexity: 696

Purity/Quality:

99%, ^*data from raw suppliers

Ovalene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C4=C1C=CC5=CC6=C7C8=C(C=CC9=C8C1=C(C=C9)C=C(C3=C1C7=C54)C=C2)C=C6
• Uses: Ovalene can be used in technical or engineered material use in polymeric nanotube dispersants and dispersant-free nanotube films therefrom.

Technology Process of Ovalene

There total 3 articles about Ovalene 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:

→ ovalene (190-26-1)

Guidance literature:

With calcium hydroxide; sodium hydroxide; at 400 ℃; under 1 Torr;

DOI:10.1038/161238b0

Reference yield:

→ ovalene (190-26-1)

Guidance literature:

With calcium hydroxide; sodium hydroxide; at 400 ℃; under 1 Torr;

DOI:10.1038/161238b0

Reference yield:

maleic anhydride (108-31-6) + anthracene (120-12-7) → ovalene (190-26-1)

Guidance literature:

Multistep reaction;

upstream raw materials:

maleic anhydride

anthracene

Downstream raw materials:

acetylene

1,2,3,6-tetrachloronaphthalene

1,2,3,6,8-pentachloronaphthalene

1,2,3,5,6-pentachloronaphthalene