Record Information
Version1.0
Creation Date2026-04-06 05:35:27 UTC
Update Date2026-08-20 07:13:31 UTC
Accession NumberCHEM118193
Identification
Common Name3,5-Bis(perfluorohexyl)-1-(nonafluoropentanoyl)-1H-pyrazole
ClassSmall Molecule
Description3,5-Bis(perfluorohexyl)-1-(nonafluoropentanoyl)-1H-pyrazole belongs to the pyrazoles, a subclass of azoles within the organic compounds. With an average molecular weight of 950.18 g/mol, 3,5-Bis(perfluorohexyl)-1-(nonafluoropentanoyl)-1H-pyrazole is a heavy molecule. This organoheterocyclic compound is identified by the chemical formula C20HF35N2O. The substance is associated with 13 recorded sources across several diverse sectors. In the realm of electrical and electronic equipment, it is found in cell phones, capacitors, wires and cables, batteries, and printed circuit boards, among one other source. It is also present in textiles, leather and furnishings, specifically within carpets, rugs, and synthetic textiles. Within the healthcare, pharmaceuticals and veterinary products sector, it is found in medical devices, while in food, food processing and cookware, it is associated with food packaging. Additionally, the compound is utilized as a lubricant within the energy, oil and gas sector as well as in industrial manufacturing and chemical processing. One other sector is also recorded as a source. Human exposure to 3,5-Bis(perfluorohexyl)-1-(nonafluoropentanoyl)-1H-pyrazole occurs through three recorded routes: inhalation, oral exposure, and touch.
Contaminant SourcesNot Available
Contaminant Type
  • PFAS
Chemical Structure
Thumb
SynonymsNot Available
Chemical FormulaC20HF35N2O
Average Molecular Mass950.185 g/mol
Monoisotopic Mass949.953 g/mol
CAS Registry Number231630-88-9
IUPAC Name1-[3,5-Bis(tridecafluorohexyl)-1H-pyrazol-1-yl]-2,2,3,3,4,4,5,5,5-nonafluoropentan-1-one
Traditional NameNot Available
SMILESFC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)N1N=C(C=C1C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI IdentifierInChI=1S/C20HF35N2O/c21-5(22,8(27,28)11(33,34)13(37,38)16(43,44)19(50,51)52)2-1-3(57(56-2)4(58)7(25,26)10(31,32)15(41,42)18(47,48)49)6(23,24)9(29,30)12(35,36)14(39,40)17(45,46)20(53,54)55/h1H
InChI KeyRZZCMOKELUIWLJ-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available