2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde (CED0213469)

Record Information
Version1.0
Creation Date2026-08-24 18:05:45 UTC
Update Date2026-08-24 18:05:45 UTC
SynCED IDCED0213469
Secondary Accession Numbers
  • CHEM252984
Identification
Common Name2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde
ClassSmall Molecule
Description
2-[tert-butyl(dimethyl)silyl]oxyacetaldehyde belongs to the organosilicon compounds, a subclass of organometalloid compounds within the organic compounds. This compound has the chemical formula C8H18O2Si and an average molecular weight of 174.31 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC8H18O2Si
Average Molecular Mass174.310 g/mol
Monoisotopic Mass174.108 g/mol
CAS Registry Number102191-92-4
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C8H18O2Si/c1-8(2,3)11(4,5)10-7-6-9/h6H,7H2,1-5H3
InChI KeyMEBFFOKESLAUSJ-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
3570.0 Log mg/kg [2000:6300]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
CEDs000511Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.Electrical & Electronic EquipmentPubChem
CEDs000519Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.Electrical & Electronic EquipmentPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000604Pest Attractants?Pest attractants are synthetic chemicals designed to lure specific pests for monitoring or control purposes.Agriculture & land managementPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
All-trans-retinol dehydrogenase [NAD(+)] ADH7 structureClick to view 3D structureAll-trans-retinol dehydrogenase [NAD(+)] ADH7P40394HumansPredicted (SEA)
Prediction Confidence Score
0.152
Applicability Domain
0.152 Low confidence
Statistical Significance
0.0112
Supporting Reference Compounds
1
E-value
86.9576
Click to view 3D structurePantothenate kinase, putativeQ8ILP4Plasmodium falciparum (isolate 3D7)Predicted (SEA)
Prediction Confidence Score
0.148
Applicability Domain
0.148 Low confidence
Statistical Significance
0.2299
Supporting Reference Compounds
1
E-value
1789.99
Histone deacetylase 1 structureClick to view 3D structureHistone deacetylase 1Q13547HumansPredicted (SEA)
Prediction Confidence Score
0.146
Applicability Domain
0.184 Low confidence
Statistical Significance
0.9899
Supporting Reference Compounds
497
E-value
7706.14
Click to view 3D structurePotassium voltage-gated channel subfamily KQT member 4Q9JK96Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.145
Applicability Domain
0.145 Low confidence
Statistical Significance
0.2267
Supporting Reference Compounds
1
E-value
1765.08
Click to view 3D structureDNA damage-inducible transcript 3 proteinP35639Mus musculusPredicted (SEA)
Prediction Confidence Score
0.141
Applicability Domain
0.147 Low confidence
Statistical Significance
0.9703
Supporting Reference Compounds
226
E-value
7553.55
X-box-binding protein 1 structureClick to view 3D structureX-box-binding protein 1P17861HumansPredicted (SEA)
Prediction Confidence Score
0.141
Applicability Domain
0.147 Low confidence
Statistical Significance
0.9705
Supporting Reference Compounds
227
E-value
7554.96
Protein RecA structureClick to view 3D structureProtein RecAP9WHJ3Mycobacterium tuberculosisPredicted (SEA)
Prediction Confidence Score
0.137
Applicability Domain
0.143 Low confidence
Statistical Significance
0.9815
Supporting Reference Compounds
296
E-value
7641.13
Click to view 3D structureHistidine biosynthesis bifunctional protein HisBP06987Escherichia coli O26:H11 str. CFSAN001629Predicted (SEA)
Prediction Confidence Score
0.136
Applicability Domain
0.136 Low confidence
Statistical Significance
0.0282
Supporting Reference Compounds
1
E-value
219.924
Inward rectifier potassium channel 2 structureClick to view 3D structureInward rectifier potassium channel 2P35561Mus musculusPredicted (SEA)
Prediction Confidence Score
0.136
Applicability Domain
0.136 Low confidence
Statistical Significance
0.3794
Supporting Reference Compounds
1
E-value
2953.52
Click to view 3D structureBeta-2 adrenergic receptorQ8K4Z4Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.136
Applicability Domain
0.17 Low confidence
Statistical Significance
0.7765
Supporting Reference Compounds
48
E-value
6045.38
Tyrosine-protein kinase JAK2 structureClick to view 3D structureTyrosine-protein kinase JAK2O60674HumansPredicted (SEA)
Prediction Confidence Score
0.135
Applicability Domain
0.138 Low confidence
Statistical Significance
0.9957
Supporting Reference Compounds
1022
E-value
7751.52
Fatty acid synthase structureClick to view 3D structureFatty acid synthaseP49327HumansPredicted (SEA)
Prediction Confidence Score
0.135
Applicability Domain
0.141 Low confidence
Statistical Significance
0.9796
Supporting Reference Compounds
117
E-value
7626.11
Sphingosine 1-phosphate receptor 4 structureClick to view 3D structureSphingosine 1-phosphate receptor 4O95977HumansPredicted (SEA)
Prediction Confidence Score
0.132
Applicability Domain
0.147 Low confidence
Statistical Significance
0.9756
Supporting Reference Compounds
117
E-value
7595.13
Protein kinase C delta type structureClick to view 3D structureProtein kinase C delta typeQ05655HumansPredicted (SEA)
Prediction Confidence Score
0.129
Applicability Domain
0.136 Low confidence
Statistical Significance
0.9972
Supporting Reference Compounds
681
E-value
7762.97
Click to view 3D structureSerine/threonine-protein phosphatase 4 catalytic subunitP60510HumansPredicted (SEA)
Prediction Confidence Score
0.129
Applicability Domain
0.129 Low confidence
Statistical Significance
0.0178
Supporting Reference Compounds
1
E-value
138.26
Alcohol dehydrogenase 1C structureClick to view 3D structureAlcohol dehydrogenase 1CP00326HumansPredicted (SEA)
Prediction Confidence Score
0.128
Applicability Domain
0.143 Low confidence
Statistical Significance
0.0089
Supporting Reference Compounds
4
E-value
69.208
DNA topoisomerase 2-alpha structureClick to view 3D structureDNA topoisomerase 2-alphaP11388HumansPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.184 Low confidence
Statistical Significance
0.8599
Supporting Reference Compounds
27
E-value
6694.49
Beta-1 adrenergic receptor structureClick to view 3D structureBeta-1 adrenergic receptorP08588HumansPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.143 Low confidence
Statistical Significance
0.9933
Supporting Reference Compounds
180
E-value
7732.53
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP22303HumansPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.147 Low confidence
Statistical Significance
0.9976
Supporting Reference Compounds
406
E-value
7766.24
Click to view 3D structureBeta-1 adrenergic receptorP18090Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.17 Low confidence
Statistical Significance
0.9189
Supporting Reference Compounds
43
E-value
7153.56
Beta-2 adrenergic receptor structureClick to view 3D structureBeta-2 adrenergic receptorP07550HumansPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.143 Low confidence
Statistical Significance
0.9963
Supporting Reference Compounds
258
E-value
7756.51
All-trans-retinol dehydrogenase [NAD(+)] ADH1B structureClick to view 3D structureAll-trans-retinol dehydrogenase [NAD(+)] ADH1BP00325HumansPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.152 Low confidence
Statistical Significance
0.0066
Supporting Reference Compounds
6
E-value
51.7697
Protein kinase C alpha type structureClick to view 3D structureProtein kinase C alpha typeP17252HumansPredicted (SEA)
Prediction Confidence Score
0.127
Applicability Domain
0.136 Low confidence
Statistical Significance
0.9954
Supporting Reference Compounds
258
E-value
7749.03
Click to view 3D structureBeta-2 adrenergic receptorQ28044Bos taurusPredicted (SEA)
Prediction Confidence Score
0.126
Applicability Domain
0.17 Low confidence
Statistical Significance
0.3825
Supporting Reference Compounds
16
E-value
2977.42
Protein deacetylase HDAC6 structureClick to view 3D structureProtein deacetylase HDAC6Q9UBN7HumansPredicted (SEA)
Prediction Confidence Score
0.125
Applicability Domain
0.143 Low confidence
Statistical Significance
0.9988
Supporting Reference Compounds
553
E-value
7775.35
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available