Phenylthiomethyl triphenylphosphonium chloride

Base Information

• Chemical Name: Phenylthiomethyl triphenylphosphonium chloride
• CAS No.: 13884-92-9
• Molecular Formula: C25H22 P S . Cl
• Molecular Weight: 420.942
• Hs Code.: 2931900090
• European Community (EC) Number: 634-276-4
• DSSTox Substance ID: DTXSID40454482
• Mol file: 13884-92-9.mol

Synonyms:13884-92-9;Phenylthiomethyl triphenylphosphonium chloride;(Phenylthio)methyltriphenylphosphonium Chloride;Triphenyl((phenylthio)methyl)phosphonium chloride;triphenyl(phenylsulfanylmethyl)phosphanium;chloride;triphenyl[(phenylsulfanyl)methyl]phosphonium chloride;SCHEMBL2451122;DTXSID40454482;OAUXBAZCEXSXGL-UHFFFAOYSA-M;AKOS024319301;FT-0605015;(Phenylthiomethyl)triphenylphosphonium chloride;triphenyl(phenylthiomethyl)phosphonium chloride;Triphenyl((phenylthio)methyl)phosphoniumchloride;J-007185;triphenyl[(phenylsulfanyl)methyl]phosphanium chloride

Chemical Property of Phenylthiomethyl triphenylphosphonium chloride

Chemical Property:

• Melting Point: 257-258°C
• PSA: 38.89000
• LogP: 2.73430
• Storage Temp.: Refrigerator
• Solubility.: Methanol, Water
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 420.0868366
• Heavy Atom Count: 28
• Complexity: 367

Purity/Quality:

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

(PHENYLTHIOMETHYL)TRIPHENYLPHOSPHONIUM CHLORIDE ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:Irritating to eyes, respiratory system and skin.
• Hazard Codes: R36/37/38:Irritating to eyes, respiratory system and skin.
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)[P+](CSC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]
• Uses: A Wittig reagent. A Wittig reagent

Technology Process of Phenylthiomethyl triphenylphosphonium chloride

There total 8 articles about Phenylthiomethyl 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: 97.0%

phenylthiomethyl chloride (7205-91-6) + triphenylphosphine (603-35-0) → phenylthiomethyl triphenylphosphonium chloride (13884-92-9)

Guidance literature:

In toluene; for 14h; Heating;

Reference yield: 93.0%

chloro-methylsulfanyl-methane (2373-51-5) + triphenylphosphine (603-35-0) → phenylthiomethyl triphenylphosphonium chloride (13884-92-9)

Guidance literature:

In acetonitrile; for 5h; Inert atmosphere; Reflux;

DOI:10.1002/ejoc.200900009

Reference yield: 70.0%

(phenylthio)-methylenetriphenylphosphorane (34884-33-8,91076-05-0) + Hexanoyl chloride (142-61-0) → phenylthiomethyl triphenylphosphonium chloride (13884-92-9) + 1-Phenylsulfanyl-1-(triphenyl-λ5-phosphanylidene)-heptan-2-one (91075-93-3)

Guidance literature:

In benzene; Ambient temperature;

DOI:10.1016/S0040-4039(01)91536-9

upstream raw materials:

phenylthiomethyl chloride

triphenylphosphine

(phenylthio)-methylenetriphenylphosphorane

benzoyl chloride

Downstream raw materials:

1-butenyl phenyl sulfide

Phenyl-3,3,3-trifluoro-2-(trifluoromethyl)-propenylsulfid

Z-3,3-Dimethylbut-1-en-1-yl-phenylsulfid

E-3,3-Dimethylbut-1-en-1-yl-phenylsulfid