Tridecafluoroheptanoyl chloride

Base Information

• Chemical Name: Tridecafluoroheptanoyl chloride
• CAS No.: 52447-22-0
• Molecular Formula: C7Cl F13 O
• Molecular Weight: 382.509
• Hs Code.: 2915900090
• European Community (EC) Number: 626-426-2
• DSSTox Substance ID: DTXSID80382154
• Nikkaji Number: J609.218G
• Wikidata: Q72500532
• Mol file: 52447-22-0.mol

Synonyms:Perfluoroheptanoyl chloride;52447-22-0;Tridecafluoroheptanoyl chloride;2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoyl Chloride;perfluoroenanthoyl chloride;SCHEMBL810833;PERFLUOROHEPTANOYLCHLORIDE;DTXSID80382154;IAHVCTQMGIVZJU-UHFFFAOYSA-N;MFCD00156013;AKOS016015538;Tridecafluoroheptanoyl chloride, >=97.0%;A829089;2,2,3,3,4,4,5,5,6,6,7,7,7-tridecakis(fluoranyl)heptanoyl chloride

Chemical Property of Tridecafluoroheptanoyl chloride

Chemical Property:

• Vapor Pressure: 20.9mmHg at 25°C
• Refractive Index: 1.295
• Boiling Point: 113.3°Cat760mmHg
• Flash Point: 22.4°C
• PSA: 17.07000
• Density: 1.709g/cm³
• LogP: 4.49060
• Sensitive.: Moisture Sensitive
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 5
• Exact Mass: 381.9430084
• Heavy Atom Count: 22
• Complexity: 450

Purity/Quality:

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

PerfluoroheptanoylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 22-34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl
• Uses: Perfluoroheptanoyl Chloride is used in process for preparation of Diacrylate with Polyfluorine chain.

Technology Process of Tridecafluoroheptanoyl chloride

There total 6 articles about Tridecafluoroheptanoyl 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: 98.0%

2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoyl fluoride (375-84-8) → perfluoroheptanoyl chloride (52447-22-0)

Guidance literature:

With aluminium trichloride; tertiary butyl chloride; at 85 - 90 ℃; for 6h;

Reference yield: 91.0%

perfluoroheptanoic acid (375-85-9) → perfluoroheptanoyl chloride (52447-22-0)

Guidance literature:

With pyridine; thionyl chloride; for 2h; Heating;

DOI:10.1016/S0022-1139(00)85181-7

Reference yield:

perfluorooct-1-ene (559-14-8) → perfluoroheptanoyl chloride (52447-22-0)

Guidance literature:

With thionyl chloride; potassium chloride; tetrabutylammomium bromide; potassium hydroxide; In dichloromethane; N,N-dimethyl-formamide; at 35 ℃; for 2.5h;

upstream raw materials:

perfluoroheptanoic acid

2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoyl fluoride

perfluoroheptanoic acid sodium salt

perfluorooct-1-ene

Downstream raw materials:

methyl perfluoroheptanoate

perfluoroenanthic acid 4-nitrophenyl ester

2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanophenone

2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-heptanoic acid (4-cyanomethyl-phenyl)-amide

Refernces

• 1、 Tanaka, Hiroshi,Tanimoto, Yosuke,Kawai, Tetsuya,Takahashi, Takashi. "A fluorous-assisted synthesis of oligosaccharides using a phenyl ether linker as a safety-catch linker". experimental part. p. 10011 - 10016. Retrieved 2012/02/05.
• 2、 Podsevalov, P. V.,Bil'dinov, I. K.,Rychkov, M. L.,Deev, L. E.,Igumnov, S. M.. "PYROLYTIC REACTIONS OF PERFLUORINATED CARBOXYLIC ACID HALIDES". . p. 1269 - 1273. Retrieved 2007/10/02.