(4-Methylbenzyl)triphenylphosphonium chloride

Base Information

• Chemical Name: (4-Methylbenzyl)triphenylphosphonium chloride
• CAS No.: 1530-37-6
• Molecular Formula: C26H24 P . Cl
• Molecular Weight: 402.903
• Hs Code.: 2931900090
• European Community (EC) Number: 667-047-2
• DSSTox Substance ID: DTXSID50934649
• ChEMBL ID: CHEMBL2041840
• Mol file: 1530-37-6.mol

Synonyms:4-methylbenzyltriphenylphosphonium chloride;p-methylbenzyltriphenylphosphonium chloride

Chemical Property of (4-Methylbenzyl)triphenylphosphonium chloride

Chemical Property:

• Melting Point: 262-264 °C
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 13.59000
• Density: g/cm³
• LogP: 2.49310
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 402.1304155
• Heavy Atom Count: 28
• Complexity: 372

Purity/Quality:

98%,99%, ^*data from raw suppliers

(4-METHYLBENZYL)TRIPHENYLPHOSPHONIUM CHLORIDE AldrichCPR ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 37/39-26

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Technology Process of (4-Methylbenzyl)triphenylphosphonium chloride

There total 7 articles about (4-Methylbenzyl)triphenylphosphonium chloride 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: 100.0%

4-Methylbenzyl chloride (104-82-5) + triphenylphosphine (603-35-0) → (4-methylbenzyl)triphenylphosphonium chloride (1530-37-6)

Guidance literature:

In acetonitrile; for 4.5h; Reflux;

DOI:10.1021/acsmedchemlett.5b00170

Reference yield: 65.0%

4-Methylbenzyl chloride (104-82-5) → (4-methylbenzyl)triphenylphosphonium chloride (1530-37-6)

Guidance literature:

With triphenylphosphine; In xylene; Heating;

DOI:10.1021/jo00152a022

Reference yield: 41.0%

4-Methylbenzyl bromide (104-81-4) + triphenylphosphine (603-35-0) → (4-methylbenzyl)triphenylphosphonium chloride (1530-37-6)

Guidance literature:

In toluene; Heating;

DOI:10.1016/S0040-4020(99)00611-0

upstream raw materials:

4-Methylbenzyl chloride

triphenylphosphine

4-Methylbenzyl alcohol

4-Methylbenzyl bromide

Downstream raw materials:

2-(4'-methylphenyl)-5-methoxybenzo[b]furan

2-p-tolyl-benzofuran

4-methyl-4'-trifluoromethyl stilbene

Refernces

• 1、 Deng, Kaini,Yang, Zuxing,Luo, Juan,Wu, Kaiqun. "Synthesis of aryl and heterocyclic polyenes and their activity in free radical scavenging". . p. 129 - 132. Retrieved 2018/04/20.
• 2、 Nomura, Sayaka,Endo-Umeda, Kaori,Makishima, Makoto,Hashimoto, Yuichi,Ishikawa, Minoru. "Development of Tetrachlorophthalimides as Liver X Receptor β (LXRβ)-Selective Agonists". . p. 2347 - 2360. Retrieved 2016/10/25.