Perfluorododecanoic acid

Base Information

• Chemical Name: Perfluorododecanoic acid
• CAS No.: 307-55-1
• Molecular Formula: C12H F23 O2
• Molecular Weight: 614.102
• Hs Code.: 29159000
• European Community (EC) Number: 206-203-2
• UNII: P6G1J7NM2D
• DSSTox Substance ID: DTXSID8031861
• Nikkaji Number: J111.002K
• Wikidata: Q27162640
• Mol file: 307-55-1.mol

Synonyms:2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tricosafluorododecanoate;perfluorododecanoate;perfluorododecanoic acid;PFDoA cpd;PFDoA, C12;PFDoDA perfluorododecanoic acid;tricosafluorododecanoate

Chemical Property of Perfluorododecanoic acid

Chemical Property:

• Appearance/Colour: white powder or chunks
• Vapor Pressure: 0.0094mmHg at 25°C
• Melting Point: 105-108 ºC
• Boiling Point: 245 ºC 740 mm Hg(lit.)
• PKA: 0.52±0.10(Predicted)
• Flash Point: 245 ºC
• PSA: 37.30000
• Density: 1.769 g/cm³
• LogP: 6.98630
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly, Heated), Methanol (Slightly)
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 25
• Rotatable Bond Count: 10
• Exact Mass: 613.9609270
• Heavy Atom Count: 37
• Complexity: 879

Purity/Quality:

99.9% ^*data from raw suppliers

Tricosafluorododecanoic Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): XiC
• Hazard Codes: Xi,C
• Statements: 36/37/38
• Safety Statements: 26-36

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(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: Perfluorododecanoic acid is a twelve-carbon compound in the perfluoroalkyl family of chemicals. It is a byproduct of stain- and greaseproof coatings on food packages, furniture, and carpets. It is known to bioaccumulate in the environment, although research related to the toxicity of the chemical is scarce.
• Uses: Perfluorododecanoic Acid is fluorinated pollutant found in wastewater and industrial runoff. Potential risk factor for coronary heart disease.

Technology Process of Perfluorododecanoic acid

There total 2 articles about Perfluorododecanoic 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:

lauric acid (143-07-7) → perfluorododecanoic acid (307-55-1)

Guidance literature:

With hydrogen fluoride; Fluorierung an Nickel-Anoden und Behandeln des Reaktionsprodukts (Tricosafluordodecanoylfluorid C₁₂F₂₄O) mit Wasser;

Reference yield:

lauric anhydride (645-66-9) → perfluorododecanoic acid (307-55-1)

Guidance literature:

With hydrogen fluoride; Fluorierung an Nickel-Anoden und Behandeln des Reaktionsprodukts (Tricosafluordodecanoylfluorid C₁₂F₂₄O) mit Wasser;

Reference yield:

perfluorododecanoic acid (307-55-1) + (4-vinyl-phenyl)-methanol (1074-61-9) → C21H9F23O2

Guidance literature:

With sodium hydroxide; In water; at 80 ℃; for 2h;

upstream raw materials:

lauric acid

lauric anhydride