2-oxopropyl(triphenyl)phosphanium (CED0276949)

Record Information
Version1.0
Creation Date2026-08-30 04:32:04 UTC
Update Date2026-08-30 04:32:04 UTC
Accession NumberCHEM322221
Identification
Common Name2-oxopropyl(triphenyl)phosphanium
ClassSmall Molecule
Description
2-oxopropyl(triphenyl)phosphanium is a chemical compound with the formula C21H20OP+ and an average molecular weight of 319.40 g/mol. This substance has been identified in or released from one recorded source: Electrical & Electronic Equipment (Radio Transmission Systems).
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC21H20OP+
Average Molecular MassNot Available
Monoisotopic Mass319.125 g/mol
CAS Registry Number89196-55-4
IUPAC NameNot Available
Traditional NameNot Available
SMILESCC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI IdentifierInChI=1S/C21H20OP/c1-18(22)17-23(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16H,17H2,1H3/q+1
InChI KeyJNNWBCPZJMSRRI-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
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
255.0Log mg/kg[140:450]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
530Radio Transmission SystemsElectrical & Electronic EquipmentNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureMast cell carboxypeptidase AP15088HumansPredicted (SEA)3.26967
Click to view 3D structureCarboxypeptidase A1P00730Bos taurusPredicted (SEA)4.82665
Mandelate racemase structureClick to view 3D structureMandelate racemaseP11444Pseudomonas putidaPredicted (SEA)1.32344
Click to view 3D structurePeptidyl-glycine alpha-amidating monooxygenaseP19021HumansPredicted (SEA)31.4511
Solute carrier family 15 member 1 structureClick to view 3D structureSolute carrier family 15 member 1P46059HumansPredicted (SEA)31.1397
Click to view 3D structureNeprilysinP07861Rattus norvegicusPredicted (SEA)72.3998
Click to view 3D structureNeprilysinP08049Oryctolagus cuniculusPredicted (SEA)94.4311
Neprilysin structureClick to view 3D structureNeprilysinP08473HumansPredicted (SEA)87.0354
Click to view 3D structureAminopeptidase NP15145Sus scrofaPredicted (SEA)72.3219
Nicotinate phosphoribosyltransferase structureClick to view 3D structureNicotinate phosphoribosyltransferaseQ6XQN6HumansPredicted (SEA)4.7488
Carboxypeptidase A1 structureClick to view 3D structureCarboxypeptidase A1P15085HumansPredicted (SEA)35.0322
Click to view 3D structureAngiotensin-converting enzymeP12822Oryctolagus cuniculusPredicted (SEA)79.3284
Click to view 3D structureNeprilysinQ61391Mus musculusPredicted (SEA)58.9319
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)276.365
Aminopeptidase N structureClick to view 3D structureAminopeptidase NP15144HumansPredicted (SEA)141.141
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)456.975
Leukotriene A-4 hydrolase structureClick to view 3D structureLeukotriene A-4 hydrolaseP09960HumansPredicted (SEA)105.564
Prostaglandin G/H synthase 1 structureClick to view 3D structureProstaglandin G/H synthase 1P23219HumansPredicted (SEA)110.157
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)416.182
Interstitial collagenase structureClick to view 3D structureInterstitial collagenaseP03956HumansPredicted (SEA)337.788
Macrophage metalloelastase structureClick to view 3D structureMacrophage metalloelastaseP39900HumansPredicted (SEA)256.669
Collagenase 3 structureClick to view 3D structureCollagenase 3P45452HumansPredicted (SEA)343.237
Histone deacetylase 4 structureClick to view 3D structureHistone deacetylase 4P56524HumansPredicted (SEA)284.228
Click to view 3D structureProstaglandin G/H synthase 1P05979Ovis ariesPredicted (SEA)90.6943
Click to view 3D structureProstaglandin G/H synthase 2P79208Ovis ariesPredicted (SEA)35.5771
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available