[ethoxy(propylsulfanyl)phosphoryl]oxybenzene (CED0041849)

Record Information
Version1.0
Creation Date2026-08-18 12:10:55 UTC
Update Date2026-08-18 12:10:55 UTC
Accession NumberCHEM159306
Identification
Common Name[ethoxy(propylsulfanyl)phosphoryl]oxybenzene
ClassSmall Molecule
Description
[ethoxy(propylsulfanyl)phosphoryl]oxybenzene belongs to the phenoxy compounds, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C11H17O3PS and an average molecular weight of 260.29 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC11H17O3PS
Average Molecular Mass260.290 g/mol
Monoisotopic Mass260.064 g/mol
CAS Registry Number40626-35-5
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C11H17O3PS/c1-3-10-16-15(12,13-4-2)14-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChI KeyXRAFOYUFLGWMQB-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
106.0Log mg/kg[60:190]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
598Fertiliser DistributorsAgriculture & land managementNot Available
602MolluscicidesAgriculture & land managementNot Available
604Pest AttractantsAgriculture & land managementNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureAcetylcholinesteraseP07140Drosophila melanogasterPredicted (SEA)0.389246
Diacylglycerol acyltransferase/mycolyltransferase Ag85C structureClick to view 3D structureDiacylglycerol acyltransferase/mycolyltransferase Ag85CP9WQN9Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)Predicted (SEA)2.25763
Urokinase-type plasminogen activator structureClick to view 3D structureUrokinase-type plasminogen activatorP00749HumansPredicted (SEA)349.932
Click to view 3D structureGIM-1 proteinQ704V1Pseudomonas aeruginosaPredicted (SEA)18.6838
Click to view 3D structureFatty-acid amide hydrolase 1O08914Mus musculusPredicted (SEA)134.134
Click to view 3D structureCannabinoid receptor 1P47746Mus musculusPredicted (SEA)52.0033
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)1057.19
Click to view 3D structureMonoglyceride lipaseO35678Mus musculusPredicted (SEA)61.5009
Kallikrein-1 structureClick to view 3D structureKallikrein-1P06870HumansPredicted (SEA)283.138
Kallikrein-4 structureClick to view 3D structureKallikrein-4Q9Y5K2HumansPredicted (SEA)107.354
Kallikrein-8 structureClick to view 3D structureKallikrein-8O60259HumansPredicted (SEA)52.6261
Kallikrein-2 structureClick to view 3D structureKallikrein-2P20151HumansPredicted (SEA)111.091
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)924.615
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)920.1
Coagulation factor X structureClick to view 3D structureCoagulation factor XP00742HumansPredicted (SEA)903.285
Click to view 3D structureAcetylcholinesteraseO42275Electrophorus electricusPredicted (SEA)752.101
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP22303HumansPredicted (SEA)1424.95
Cholinesterase structureClick to view 3D structureCholinesteraseP06276HumansPredicted (SEA)893.086
Click to view 3D structureGlutamyl endopeptidaseP0C1U8Staphylococcus aureusPredicted (SEA)97.6229
Click to view 3D structureAcetylcholinesteraseP21836Mus musculusPredicted (SEA)316.691
Plasminogen structureClick to view 3D structurePlasminogenP00747HumansPredicted (SEA)861.402
Click to view 3D structureNeuronal acetylcholine receptor subunit alpha-7P22770Gallus gallusPredicted (SEA)24.4447
Click to view 3D structureCarbonic anhydrase 13Q9D6N1Mus musculusPredicted (SEA)301.899
UDP-3-O-acyl-N-acetylglucosamine deacetylase structureClick to view 3D structureUDP-3-O-acyl-N-acetylglucosamine deacetylaseO67648Aquifex aeolicus (strain VF5)Predicted (SEA)178.82
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)1922.56
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available