Hexyltriphenylphosphonium iodide

Base Information

• Chemical Name: Hexyltriphenylphosphonium iodide
• CAS No.: 60106-53-8
• Molecular Formula: C24H28IP
• Molecular Weight: 474.365
• Hs Code.: 2931900090
• European Community (EC) Number: 633-134-9
• DSSTox Substance ID: DTXSID90451108
• Mol file: 60106-53-8.mol

Synonyms:Hexyltriphenylphosphonium iodide;60106-53-8;Hexyltriphenylphosphoniumiodide;hexyl(triphenyl)phosphanium;iodide;SCHEMBL2354963;n-hexyltriphenylphosphonium iodide;DTXSID90451108;NSQDXDMFAYCVFH-UHFFFAOYSA-M;hexyltriphenylphosphonium, iodide salt;FT-0640657

Chemical Property of Hexyltriphenylphosphonium iodide

Chemical Property:

• Melting Point: 131-133 °C(lit.)
• PSA: 13.59000
• LogP: 2.56480
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 474.09734
• Heavy Atom Count: 26
• Complexity: 300

Purity/Quality:

98%min ^*data from raw suppliers

HEXYLTRIPHENYLPHOSPHONIUM IODIDE 98.00% ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Technology Process of Hexyltriphenylphosphonium iodide

There total 2 articles about Hexyltriphenylphosphonium iodide 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: 98.0%

1-Iodohexane (638-45-9) + triphenylphosphine (603-35-0) → n-hexyltriphenylphosphonium iodide (60106-53-8)

Guidance literature:

In benzene; for 24h; Heating;

DOI:10.1071/C96180

Reference yield:

→ n-hexyltriphenylphosphonium iodide (60106-53-8)

Guidance literature:

Reference yield: 93.0%

n-hexyltriphenylphosphonium iodide (60106-53-8) + 4-Bromo-benzoic acid (1S,2R,3S,5S)-3-benzyloxymethoxy-5-(tert-butyl-dimethyl-silanyloxy)-2-(2-oxo-ethyl)-cyclopentylmethyl ester (185114-44-7) → 4-Bromo-benzoic acid (1S,2R,3S,5S)-3-benzyloxymethoxy-5-(tert-butyl-dimethyl-silanyloxy)-2-((Z)-oct-2-enyl)-cyclopentylmethyl ester

Guidance literature:

With N,N,N,N,N,N-hexamethylphosphoric triamide; n-butyllithium;

DOI:10.1016/S0040-4039(97)10211-8

upstream raw materials:

1-Iodohexane

triphenylphosphine

Downstream raw materials:

2(R),3(R) 1,2-O-isopropylidene-3-O-benzoyl-5Z-undecene

hexylidenetriphenylphosphoran

1-Methoxy-4-((Z)-(R)-2-methyl-non-3-enyloxymethyl)-benzene

1-((Z)-(R)-2-Ethyl-non-3-enyloxymethyl)-4-methoxy-benzene