2-Bromo-1-(4-methoxynaphthalen-1-yl)ethanone

Base Information

• Chemical Name: 2-Bromo-1-(4-methoxynaphthalen-1-yl)ethanone
• CAS No.: 5471-35-2
• Molecular Formula: C13H11 Br O2
• Molecular Weight: 279.13
• NSC Number: 26064
• DSSTox Substance ID: DTXSID30282478
• Wikidata: Q82016764
• ChEMBL ID: CHEMBL260489
• Mol file: 5471-35-2.mol

Synonyms:5471-35-2;2-bromo-1-(4-methoxynaphthalen-1-yl)ethanone;2-bromo-1-(4-methoxynaphthalen-1-yl)ethan-1-one;NSC26064;Methoxynaphthalen-1-yl, 8;CHEMBL260489;SCHEMBL4519297;BDBM21620;DTXSID30282478;NSC 26064;NSC-26064

Chemical Property of 2-Bromo-1-(4-methoxynaphthalen-1-yl)ethanone

Chemical Property:

• Vapor Pressure: 6.59E-07mmHg at 25°C
• Boiling Point: 409.2°Cat760mmHg
• Flash Point: 201.3°C
• PSA: 26.30000
• Density: 1.451g/cm³
• LogP: 3.42600
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 277.99424
• Heavy Atom Count: 16
• Complexity: 254

Purity/Quality:

99% ^*data from raw suppliers

2-Bromo-1-(4-methoxynaphthalen-1-yl)ethanone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C2=CC=CC=C21)C(=O)CBr

Technology Process of 2-Bromo-1-(4-methoxynaphthalen-1-yl)ethanone

There total 5 articles about 2-Bromo-1-(4-methoxynaphthalen-1-yl)ethanone 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: 86.0%

→ 2-bromo-1-(4-methoxy-1-naphthyl)ethanone (5471-35-2)

Guidance literature:

Reference yield: 44.0%

1-acetyl-4-methoxynaphthalene (24764-66-7) → 2-bromo-1-(4-methoxy-1-naphthyl)ethanone (5471-35-2)

Guidance literature:

With copper(ll) bromide; In chloroform; ethyl acetate; for 5h; Reflux;

DOI:10.3762/bjoc.10.212

Reference yield:

2-Bromoacetyl bromide (598-21-0) + 1-Methoxynaphthalene (2216-69-5) → 2-bromo-1-(4-methoxy-1-naphthyl)ethanone (5471-35-2)

Guidance literature:

With carbon disulfide; aluminium trichloride;

DOI:10.1359/jbmr.2001.16.2.386

upstream raw materials:

1-acetyl-4-methoxynaphthalene

2-Bromoacetyl bromide

1-Methoxynaphthalene

2-bromoacetyl chloride

Downstream raw materials:

1-(4-Methoxy-naphthalen-1-yl)-2-phenylamino-ethanone

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