1-Methoxybenzo[c]phenanthrene

Base Information

• Chemical Name: 1-Methoxybenzo[c]phenanthrene
• CAS No.: 4235-05-6
• Molecular Formula: C₁₉H₁₄O
• Molecular Weight: 258.32
• NSC Number: 97699
• DSSTox Substance ID: DTXSID90294673
• Nikkaji Number: J3.052.572H
• Wikidata: Q82034074
• Mol file: 4235-05-6.mol

Synonyms:1-methoxybenzo[c]phenanthrene;4235-05-6;NSC97699;DTXSID90294673;NSC-97699

Chemical Property of 1-Methoxybenzo[c]phenanthrene

Chemical Property:

• Vapor Pressure: 1.57E-08mmHg at 25°C
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 258.104465066
• Heavy Atom Count: 20
• Complexity: 339

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=CC2=C1C3=C(C=C2)C=CC4=CC=CC=C43

Technology Process of 1-Methoxybenzo[c]phenanthrene

There total 2 articles about 1-Methoxybenzo[c]phenanthrene 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: 78.0%

1-(2-ethynyl-6-methoxyphenyl)-naphthalene → 1-methoxybenzo[c]phenathrene (4235-05-6)

Guidance literature:

platinum(II) chloride; In toluene; at 90 ℃; for 20h;

DOI:10.1016/j.tetlet.2007.07.105

Reference yield:

→ 1-methoxybenzo[c]phenathrene (4235-05-6)

Guidance literature:

1-Methoxy-5,8-dioxo-5,6,6a.7.8.12b-hexahydro-benzophenanthren VIIa, NaBH4 in methanol. NaOH <2h Raumtemp., 2h 50grad> --> Diol (Stereoisomere) + I2 in sd. Xylol Zw.-Prod.--> + S <30 min., 240-250grad>, Zn-Staub-Dest. <1.5 Torr>;

DOI:10.1021/ja01057a044

Reference yield: 88.0%

1-methoxybenzo[c]phenathrene (4235-05-6) → 1-Hydroxy-benzophenanthren (22717-93-7)

Guidance literature:

With boron tribromide; In dichloromethane; at 20 ℃;

DOI:10.1016/j.tetlet.2007.07.105

Downstream raw materials:

1-Hydroxy-benzophenanthren

Refernces