1,2,6-Trimethylphenanthrene

Base Information

• Chemical Name: 1,2,6-Trimethylphenanthrene
• CAS No.: 30436-55-6
• Molecular Formula: C₁₇H₁₆
• Molecular Weight: 220.314
• DSSTox Substance ID: DTXSID00697818
• Wikidata: Q82627838
• Mol file: 30436-55-6.mol

Synonyms:1,2,6-TRIMETHYLPHENANTHRENE;30436-55-6;1,2,6-Trimethyl-phenanthrene;Phenanthrene, 1,2,6-trimethyl-;pentaerythritoltetraacrylate;Trimethylphenanthrene, 1,2,6-;DTXSID00697818;FT-0731667

Chemical Property of 1,2,6-Trimethylphenanthrene

Chemical Property:

• Melting Point: 128.5-129.0 °C(Solv: ethanol (64-17-5); ligroine (8032-32-4))
• Boiling Point: 174-192 °C(Press: 0.01 Torr)
• Density: 1.066±0.06 g/cm3(Predicted)
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Ethyl Acetate (Slightly)
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 220.125200510
• Heavy Atom Count: 17
• Complexity: 269

Purity/Quality:

99%min ^*data from raw suppliers

1,2,6-Trimethyl-phenanthrene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)C=CC3=C2C=CC(=C3C)C
• Uses: 1,2,6-Trimethylphenanthrene is a persistent organic pollutant (POP).

Technology Process of 1,2,6-Trimethylphenanthrene

There total 3 articles about 1,2,6-Trimethylphenanthrene 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:

aescigenin (17806-68-7) → 2,7-dimethylnaphthalene (582-16-1) + 1,2,5,6-tetramethylnaphthalene (2131-43-3) + 1,2,6-trimethyl-phenanthrene (30436-55-6) + 1,2,5-trimethylnaphthalene (641-91-8)

Guidance literature:

at 350 ℃;

DOI:10.1002/hlca.19490320633

Reference yield:

22β-[(3-methyl-1-oxo-2-butenyl)oxy]-3-oxoolean-12-en-28-oic acid (467-82-3) → 1,2,6-trimethyl-phenanthrene (30436-55-6) + 1,2,7-trimethylnaphthalene (486-34-0)

Guidance literature:

at 350 ℃;

Reference yield:

lantadene A (467-81-2) → 1,2,6-trimethyl-phenanthrene (30436-55-6) + 1,2,7-trimethylnaphthalene (486-34-0)

Guidance literature:

at 360 ℃;

upstream raw materials:

aescigenin

22β-[(3-methyl-1-oxo-2-butenyl)oxy]-3-oxoolean-12-en-28-oic acid

lantadene A