3-Acetyl-9-bromophenanthrene

Base Information

• Chemical Name: 3-Acetyl-9-bromophenanthrene
• CAS No.: 6328-08-1
• Molecular Formula: C₁₆H₁₁BrO
• Molecular Weight: 299.167
• Hs Code.: 2914700090
• NSC Number: 44475
• DSSTox Substance ID: DTXSID70286253
• Nikkaji Number: J151.375C
• Wikidata: Q82021920
• Mol file: 6328-08-1.mol

Synonyms:3-Acetyl-9-bromophenanthrene;1-(9-bromophenanthren-3-yl)ethanone;6328-08-1;NSC44475;SCHEMBL10081753;DTXSID70286253;PODNEAAXQLNICQ-UHFFFAOYSA-N;NSC-44475;1-(9-Bromo-3-phenanthryl)ethanone #

Chemical Property of 3-Acetyl-9-bromophenanthrene

Chemical Property:

• Vapor Pressure: 2.07E-08mmHg at 25°C
• Boiling Point: 453.4°C at 760 mmHg
• Flash Point: 113.6°C
• PSA: 17.07000
• Density: 1.456g/cm³
• LogP: 4.95810
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 297.99933
• Heavy Atom Count: 18
• Complexity: 327

Purity/Quality:

3-ACETYL-9-BROMOPHENANTHRENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC2=C(C=C1)C=C(C3=CC=CC=C32)Br

Technology Process of 3-Acetyl-9-bromophenanthrene

There total 3 articles about 3-Acetyl-9-bromophenanthrene 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:

9-bromophenanthrene (573-17-1) + acetyl chloride (75-36-5) → 3-acetyl-9-bromophenanthrene (6328-08-1)

Guidance literature:

With carbon disulfide; aluminium trichloride; at 5 ℃;

DOI:10.1021/jo01174a004 DOI:10.1021/ja01347a046

Reference yield:

9-bromophenanthrene (573-17-1) + acetyl chloride (75-36-5) → 3-acetyl-9-bromophenanthrene (6328-08-1)

Guidance literature:

With aluminum (III) chloride;

DOI:10.1021/jm201230z

Reference yield:

carbon disulfide (75-15-0,12122-00-8) + aluminium trichloride (7446-70-0) + 9-bromophenanthrene (573-17-1) + acetyl chloride (75-36-5) → 3-acetyl-9-bromophenanthrene (6328-08-1)

Guidance literature:

unter Kuehlung;

DOI:10.1021/jo01174a004 DOI:10.1021/ja01347a046

upstream raw materials:

carbon disulfide

aluminium trichloride

9-bromophenanthrene

acetyl chloride

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