Phenylsodium

Base Information

• Chemical Name: Phenylsodium
• CAS No.: 1623-99-0
• Molecular Formula: C6H5 Na
• Molecular Weight: 100.095
• Hs Code.: 2931900090
• UNII: SNA8TW8V4T
• DSSTox Substance ID: DTXSID301316871
• Wikipedia: Phenylsodium
• Wikidata: Q4482605
• Mol file: 1623-99-0.mol

Synonyms:Phenylsodium;Sodiobenzene;sodium;benzene;Sodium, phenyl-;SNA8TW8V4T;Benzene sodium salt [MI];1623-99-0;UNII-SNA8TW8V4T;phenylsodium25per centsoln.inheptane;phenyl sodium;phenyl-sodium;WITPRUKIHAMIAQ-UHFFFAOYSA-N;DTXSID301316871;Q4482605

Chemical Property of Phenylsodium

Chemical Property:

• Melting Point: 105 °C (decomp)
• PSA: 0.00000
• LogP: 1.48680
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 100.02889444
• Heavy Atom Count: 7
• Complexity: 95.8

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s): 3
• Hazard Codes: 3

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=[C-]C=C1.[Na+]

Technology Process of Phenylsodium

There total 19 articles about Phenylsodium 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:

diphenylether (101-84-8) + 2-Phenylphenol (90-43-7,287950-96-3) → (1,1';3',1''-terphenyl)-2'-ol (2432-11-3) + phenyl sodium (1623-99-0) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) + phenol (108-95-2,27073-41-2)

Guidance literature:

Reference yield:

n-pentylsodium (1822-71-5) + chlorobenzene (108-90-7) → biphenyl (92-52-4,1594-86-1) + decane (124-18-5) + pentylbenzene (538-68-1) + phenyl sodium (1623-99-0)

Guidance literature:

DOI:10.1021/ja01273a046 DOI:10.1021/ja01262a003

Reference yield:

sodium (7440-23-5) + chlorobenzene (108-90-7) → phenyl sodium (1623-99-0)

Guidance literature:

In toluene; at 27 - 40 ℃; for 1h;

upstream raw materials:

bromobenzene

n-pentylsodium

chlorobenzene

diphenylether

Downstream raw materials:

4-benzyl-1-methyl-piperidine-4-carbonitrile

(1-methylpiperidin-4-yl)(phenyl)methanone

4-cyano-1-methyl-quinuclidinium; chloride

triphenylene

Refernces

• 1、 -. "Method of preparation of methyl-benzyl-ketone". Page/Page column 4-5. . Retrieved 2008/06/13.
• 2、 -. "Process for the preparation of benzyl-metal compounds and process for the preparation of 4-phenyl-1-butenes by the use of the same". . . Retrieved 2008/06/13.