Bis[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phenylphosphine (CED0078257)

Record Information
Version1.0
Creation Date2026-04-06 06:30:22 UTC
Update Date2026-08-22 12:06:49 UTC
SynCED IDCED0078257
Secondary Accession Numbers
  • CHEM119043
Identification
Common NameBis[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phenylphosphine
ClassSmall Molecule
Description
Bis[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phenylphosphine belongs to the phenylphosphines and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. With an average molecular weight of 1,155 g/mol, Bis[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phenylphosphine is a heavy molecule. It has the chemical formula C38H21F34P. The compound is found in or released from 13 recorded sources across several sectors. In electrical and electronic equipment, it is associated with capacitors, cell phones, printed circuit boards, wires and cables, batteries, and one additional source. Within the textiles, leather and furnishings sector, it is linked to carpets, rugs, and synthetic textiles. It is also found in food packaging within the food, food processing and cookware sector. Other recorded sources include medical devices from the healthcare, pharmaceuticals and veterinary products sector, as well as lubricants used in energy, oil and gas, and industrial manufacturing and chemical processing. One additional sector is also recorded. Exposure routes for this compound include touch, oral, and inhalation.
Contaminant Type
  • PFAS
Chemical Structure
SynonymsNot Available
Chemical FormulaC38H21F34P
Average Molecular Mass1154.505 g/mol
Monoisotopic Mass1154.084 g/mol
CAS Registry Number892154-91-5
IUPAC NameNot Available
Traditional NameNot Available
SMILESFC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCC1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C=C1
InChI IdentifierInChI=1S/C38H21F34P/c39-23(40,25(43,44)27(47,48)29(51,52)31(55,56)33(59,60)35(63,64)37(67,68)69)16-14-18-6-10-21(11-7-18)73(20-4-2-1-3-5-20)22-12-8-19(9-13-22)15-17-24(41,42)26(45,46)28(49,50)30(53,54)32(57,58)34(61,62)36(65,66)38(70,71)72/h1-13H,14-17H2
InChI KeyGMHNZJNJORCMQJ-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
2063.0 Log mg/kg [1200:3700]RatLD50oralpredictedNot AvailableNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000007Pesticides?Pesticides are synthetic chemicals designed to prevent, destroy, or control pests that threaten crops and agricultural productivity.Agriculture & land managementNot Available
CEDs000120Wires and cables?Wires and cables are integral components in the transmission of electrical power and signals.Electrical & Electronic EquipmentNot Available
CEDs000121Printed circuit boards?Printed circuit boards (PCBs) are essential components in the manufacturing of electronic devices, serving as the backbone for electrical connections and circuit pathways.Electrical & Electronic EquipmentNot Available
CEDs000125Batteries?Batteries are devices that store and release electrical energy through electrochemical reactions.Electrical & Electronic EquipmentNot Available
CEDs000130Semiconductors?Semiconductors are materials that possess electrical conductivity between that of conductors and insulators, making them essential for various electronic applications, including transistors, diodes, and integrated circuits.Electrical & Electronic EquipmentNot Available
CEDs000138Lubricants?Lubricants are synthetic or petroleum-derived substances used to reduce friction between surfaces in machinery and equipment, enhancing operational efficiency and longevity.Energy, oil & gasNot Available
CEDs000147Food packaging?Food packaging often utilizes synthetic chemicals, such as plastics and coatings, to enhance durability, moisture resistance, and shelf life.Food, food processing & cookwareNot Available
CEDs000174Lubricants?Lubricants are synthetic or petroleum-based substances used to reduce friction and wear between moving parts in machinery and equipment.Industrial manufacturing & chemical processingNot Available
CEDs000234Medical devices?Medical devices often incorporate synthetic chemicals in their manufacturing processes, which can contribute to contamination in healthcare settings.Healthcare, pharmaceuticals & veterinary productsNot Available
CEDs000451Carpets and Rugs?Carpets and rugs are commonly manufactured using synthetic fibers such as nylon, polyester, and polypropylene, which can be derived from petrochemical sources.Textiles, leather & furnishingsNot Available
CEDs000454Synthetic textiles?Synthetic textiles are materials derived from man-made fibers, such as polyester, nylon, and acrylic, which are produced through chemical processes involving petrochemicals.Textiles, leather & furnishingsNot Available
CEDs000490Personal care & cosmeticsNot Available
CEDs000492Cell phones?Cell phones contain a variety of synthetic chemicals and materials, including plastics, metals, and glass, which can contribute to environmental contamination.Electrical & Electronic EquipmentNot Available
CEDs000493Capacitors?Capacitors are electronic components that store and release electrical energy, often using dielectric materials that can include synthetic chemicals.Electrical & Electronic EquipmentNot Available
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
72 kDa type IV collagenase structureClick to view 3D structure72 kDa type IV collagenaseP08253HumansPredicted (SEA)
Prediction Confidence Score
0.23
Applicability Domain
0.255 Low confidence
Statistical Significance
0.2806
Supporting Reference Compounds
400
E-value
2184.14
Phospholipase A and acyltransferase 4 structureClick to view 3D structurePhospholipase A and acyltransferase 4Q9UL19HumansPredicted (SEA)
Prediction Confidence Score
0.226
Applicability Domain
0.226 Low confidence
Statistical Significance
0.0216
Supporting Reference Compounds
1
E-value
168.466
Click to view 3D structurePhospholipase A and acyltransferase 5Q96KN8HumansPredicted (SEA)
Prediction Confidence Score
0.226
Applicability Domain
0.226 Low confidence
Statistical Significance
0.0216
Supporting Reference Compounds
1
E-value
168.466
Phospholipase A and acyltransferase 3 structureClick to view 3D structurePhospholipase A and acyltransferase 3P53816HumansPredicted (SEA)
Prediction Confidence Score
0.226
Applicability Domain
0.226 Low confidence
Statistical Significance
0.0216
Supporting Reference Compounds
1
E-value
168.466
Phospholipase A and acyltransferase 2 structureClick to view 3D structurePhospholipase A and acyltransferase 2Q9NWW9HumansPredicted (SEA)
Prediction Confidence Score
0.226
Applicability Domain
0.226 Low confidence
Statistical Significance
0.0216
Supporting Reference Compounds
1
E-value
168.466
Neutrophil collagenase structureClick to view 3D structureNeutrophil collagenaseP22894HumansPredicted (SEA)
Prediction Confidence Score
0.224
Applicability Domain
0.255 Low confidence
Statistical Significance
0.1916
Supporting Reference Compounds
176
E-value
1491.36
Matrix metalloproteinase-9 structureClick to view 3D structureMatrix metalloproteinase-9P14780HumansPredicted (SEA)
Prediction Confidence Score
0.222
Applicability Domain
0.255 Low confidence
Statistical Significance
0.305
Supporting Reference Compounds
292
E-value
2374.17
Troponin C, slow skeletal and cardiac muscles structureClick to view 3D structureTroponin C, slow skeletal and cardiac musclesP63316HumansPredicted (SEA)
Prediction Confidence Score
0.22
Applicability Domain
0.22 Low confidence
Statistical Significance
0.0048
Supporting Reference Compounds
2
E-value
37.6012
Sigma non-opioid intracellular receptor 1 structureClick to view 3D structureSigma non-opioid intracellular receptor 1Q99720HumansPredicted (SEA)
Prediction Confidence Score
0.218
Applicability Domain
0.25 Low confidence
Statistical Significance
0.5163
Supporting Reference Compounds
562
E-value
4019.67
Trace amine-associated receptor 1 structureClick to view 3D structureTrace amine-associated receptor 1Q96RJ0HumansPredicted (SEA)
Prediction Confidence Score
0.216
Applicability Domain
0.263 Low confidence
Statistical Significance
0.1116
Supporting Reference Compounds
63
E-value
868.875
Click to view 3D structureSigma non-opioid intracellular receptor 1Q9R0C9Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.215
Applicability Domain
0.25 Low confidence
Statistical Significance
0.2204
Supporting Reference Compounds
207
E-value
1715.49
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)
Prediction Confidence Score
0.214
Applicability Domain
0.25 Low confidence
Statistical Significance
0.4301
Supporting Reference Compounds
472
E-value
3348.22
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)
Prediction Confidence Score
0.214
Applicability Domain
0.25 Low confidence
Statistical Significance
0.3785
Supporting Reference Compounds
407
E-value
2946.44
Click to view 3D structureSigma non-opioid intracellular receptor 1Q60492Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.212
Applicability Domain
0.25 Low confidence
Statistical Significance
0.3234
Supporting Reference Compounds
229
E-value
2517.41
Collagenase 3 structureClick to view 3D structureCollagenase 3P45452HumansPredicted (SEA)
Prediction Confidence Score
0.21
Applicability Domain
0.255 Low confidence
Statistical Significance
0.415
Supporting Reference Compounds
269
E-value
3230.74
Matrix metalloproteinase-14 structureClick to view 3D structureMatrix metalloproteinase-14P50281HumansPredicted (SEA)
Prediction Confidence Score
0.21
Applicability Domain
0.255 Low confidence
Statistical Significance
0.3286
Supporting Reference Compounds
198
E-value
2557.81
5-hydroxytryptamine receptor 2A structureClick to view 3D structure5-hydroxytryptamine receptor 2AP14842Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.209
Applicability Domain
0.263 Low confidence
Statistical Significance
0.4555
Supporting Reference Compounds
380
E-value
3546.42
Interstitial collagenase structureClick to view 3D structureInterstitial collagenaseP03956HumansPredicted (SEA)
Prediction Confidence Score
0.208
Applicability Domain
0.255 Low confidence
Statistical Significance
0.4225
Supporting Reference Compounds
258
E-value
3288.97
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)
Prediction Confidence Score
0.207
Applicability Domain
0.222 Low confidence
Statistical Significance
0.7639
Supporting Reference Compounds
1103
E-value
5946.59
Sodium-dependent noradrenaline transporter structureClick to view 3D structureSodium-dependent noradrenaline transporterP23975HumansPredicted (SEA)
Prediction Confidence Score
0.204
Applicability Domain
0.255 Low confidence
Statistical Significance
0.6476
Supporting Reference Compounds
451
E-value
5041.9
Cytochrome P450 2A6 structureClick to view 3D structureCytochrome P450 2A6P11509HumansPredicted (SEA)
Prediction Confidence Score
0.203
Applicability Domain
0.263 Low confidence
Statistical Significance
0.0557
Supporting Reference Compounds
68
E-value
434.009
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)
Prediction Confidence Score
0.203
Applicability Domain
0.22 Low confidence
Statistical Significance
0.46
Supporting Reference Compounds
332
E-value
3580.91
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)
Prediction Confidence Score
0.202
Applicability Domain
0.22 Low confidence
Statistical Significance
0.4941
Supporting Reference Compounds
372
E-value
3846.61
Click to view 3D structureSodium-dependent serotonin transporterP31652Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.202
Applicability Domain
0.229 Low confidence
Statistical Significance
0.4482
Supporting Reference Compounds
297
E-value
3489.36
Macrophage metalloelastase structureClick to view 3D structureMacrophage metalloelastaseP39900HumansPredicted (SEA)
Prediction Confidence Score
0.201
Applicability Domain
0.255 Low confidence
Statistical Significance
0.3796
Supporting Reference Compounds
136
E-value
2954.92
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available