Perfluorotetradecanoic acid

Base Information

• Chemical Name: Perfluorotetradecanoic acid
• CAS No.: 376-06-7
• Molecular Formula: C14HF27O2
• Molecular Weight: 714.118
• Hs Code.: 29159000
• European Community (EC) Number: 206-803-4
• UNII: CY7BGN3727
• DSSTox Substance ID: DTXSID3059921
• Nikkaji Number: J213.588D
• Wikidata: Q63399417
• Mol file: 376-06-7.mol

Synonyms:2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoate;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid;heptacosafluorotetradecanoate;heptacosafluorotetradecanoic acid;methyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoate;methyl perfluorotetradecanoate;perfluoromyristic acid;perfluorotetradecanoate;perfluorotetradecanoic acid;PFTA perfluorotetradecanoic acid;PFTreA perfluorotetradecanoic acid

Chemical Property of Perfluorotetradecanoic acid

Chemical Property:

• Appearance/Colour: off-white crystalline powder
• Vapor Pressure: 0.00137mmHg at 25°C
• Melting Point: 130-135 °C(lit.)
• Refractive Index: 1.288
• Boiling Point: 275.689 °C at 760 mmHg
• PKA: 0.52±0.10(Predicted)
• Flash Point: 120.533 °C
• PSA: 37.30000
• Density: 1.777 g/cm³
• LogP: 8.25690
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform (Slightly, Heated, Sonicated), Methanol (Slightly, Sonicated)
• Water Solubility.: It is insoluble in water.
• XLogP3: 9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 29
• Rotatable Bond Count: 12
• Exact Mass: 713.9545396
• Heavy Atom Count: 43
• Complexity: 1060

Purity/Quality:

99.9% ^*data from raw suppliers

Perfluorotetradecanoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: PFAS
• Canonical SMILES: C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
• Uses: Fluorinating agent Perfluorotetradecanoic acid is used for GC (Gas Chromatography) and LC (Liquid Chromatography) analysis.

Technology Process of Perfluorotetradecanoic acid

There total 3 articles about Perfluorotetradecanoic acid 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: 94.8%

→ perfluorotetradecanoic acid (376-06-7)

Guidance literature:

With water;

Reference yield:

n-tetradecanoic acid (544-63-8) → perfluorotetradecanoic acid (376-06-7)

Guidance literature:

With hydrogen fluoride; bei der Fluorierung und Behandeln des gebildeten Heptacosafluortetradecanoylfluorids mit Wasser;

DOI:10.1021/ie50502a044

Reference yield:

myristic anhydride (626-29-9) → perfluorotetradecanoic acid (376-06-7)

Guidance literature:

With hydrogen fluoride; bei der Fluorierung und Behandeln des gebildeten Heptacosafluortetradecanoylfluorids mit Wasser;

DOI:10.1021/ie50502a044

upstream raw materials:

n-tetradecanoic acid

myristic anhydride

Downstream raw materials:

perfluorotridecyl iodide