1-(3-ethoxypropoxy)propan-1-ol (CED0213471)

Record Information
Version1.0
Creation Date2026-08-24 18:05:58 UTC
Update Date2026-08-24 18:05:58 UTC
SynCED IDCED0213471
Secondary Accession Numbers
  • CHEM252987
Identification
Common Name1-(3-ethoxypropoxy)propan-1-ol
ClassSmall Molecule
Description
1-(3-ethoxypropoxy)propan-1-ol is an organic oxygen compound with the formula C8H18O3 and an average molecular weight of 162.23 g/mol. 1-(3-ethoxypropoxy)propan-1-ol belongs to the ethers, a subclass of organooxygen compounds within the organic compounds. This substance has been identified in one recorded source, specifically within household cleaning and consumer products such as soap dispensers.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC8H18O3
Average Molecular Mass162.230 g/mol
Monoisotopic Mass162.126 g/mol
CAS Registry Number30025-38-8
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C8H18O3/c1-3-8(9)11-7-5-6-10-4-2/h8-9H,3-7H2,1-2H3
InChI KeyGEZOSPWWMQDYMS-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
3271.0 Log mg/kg [1800:5800]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
CEDs000561Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.Household cleaning & consumer productsPubChem
CEDs000564Soap Dispensers?Soap dispensers, commonly used for dispensing liquid soaps and sanitizers, can become a source of synthetic chemical contamination due to the materials used in their construction and the products they dispense.Household cleaning & consumer productsPubChem
CEDs000727Printing Machines Or Presses?Printing machines or presses commonly utilize synthetic chemicals such as inks, solvents, and cleaning agents.Paper, pulp & fiber productsPubChem
CEDs000740Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.Paper, pulp & fiber productsPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureCAI-1 autoinducer sensor kinase/phosphatase CqsSQ9KM66Vibrio cholerae serotype O1 (strain ATCC 39315 / El Tor Inaba N16961)Predicted (SEA)
Prediction Confidence Score
0.222
Applicability Domain
0.222 Low confidence
Statistical Significance
0.0032
Supporting Reference Compounds
1
E-value
25.0674
Click to view 3D structurePutative inactive group IIC secretory phospholipase A2Q5R387HumansPredicted (SEA)
Prediction Confidence Score
0.213
Applicability Domain
0.213 Low confidence
Statistical Significance
0.0053
Supporting Reference Compounds
1
E-value
41.3379
Neutral ceramidase structureClick to view 3D structureNeutral ceramidaseQ9NR71HumansPredicted (SEA)
Prediction Confidence Score
0.21
Applicability Domain
0.21 Low confidence
Statistical Significance
0.0123
Supporting Reference Compounds
1
E-value
95.9102
UDP-3-O-acyl-N-acetylglucosamine deacetylase structureClick to view 3D structureUDP-3-O-acyl-N-acetylglucosamine deacetylaseO67648Aquifex aeolicus (strain VF5)Predicted (SEA)
Prediction Confidence Score
0.19
Applicability Domain
0.19 Low confidence
Statistical Significance
0.0612
Supporting Reference Compounds
1
E-value
476.749
Acylcarnitine hydrolase structureClick to view 3D structureAcylcarnitine hydrolaseQ91WG0Mus musculusPredicted (SEA)
Prediction Confidence Score
0.19
Applicability Domain
0.237 Low confidence
Statistical Significance
0.0051
Supporting Reference Compounds
2
E-value
39.3917
Click to view 3D structureCeramide glucosyltransferaseO88693Mus musculusPredicted (SEA)
Prediction Confidence Score
0.182
Applicability Domain
0.188 Low confidence
Statistical Significance
0.0086
Supporting Reference Compounds
14
E-value
66.7168
Lysophosphatidic acid receptor 2 structureClick to view 3D structureLysophosphatidic acid receptor 2Q9HBW0HumansPredicted (SEA)
Prediction Confidence Score
0.18
Applicability Domain
0.238 Low confidence
Statistical Significance
0.1597
Supporting Reference Compounds
30
E-value
1243.64
Click to view 3D structureLysophosphatidic acid receptor 3Q9UBY5HumansPredicted (SEA)
Prediction Confidence Score
0.18
Applicability Domain
0.238 Low confidence
Statistical Significance
0.0858
Supporting Reference Compounds
21
E-value
667.635
Click to view 3D structureNon-lysosomal glucosylceramidaseQ9HCG7HumansPredicted (SEA)
Prediction Confidence Score
0.18
Applicability Domain
0.188 Low confidence
Statistical Significance
0.0137
Supporting Reference Compounds
21
E-value
107.043
Click to view 3D structure1-deoxy-D-xylulose-5-phosphate synthaseB7UJP3Escherichia coli O127:H6 (strain E2348/69 / EPEC)Predicted (SEA)
Prediction Confidence Score
0.178
Applicability Domain
0.184 Low confidence
Statistical Significance
0.0025
Supporting Reference Compounds
2
E-value
19.5402
Lysophosphatidic acid receptor 6 structureClick to view 3D structureLysophosphatidic acid receptor 6P43657HumansPredicted (SEA)
Prediction Confidence Score
0.175
Applicability Domain
0.238 Low confidence
Statistical Significance
0.0052
Supporting Reference Compounds
3
E-value
40.248
Click to view 3D structureCocaine esteraseO00748HumansPredicted (SEA)
Prediction Confidence Score
0.171
Applicability Domain
0.237 Low confidence
Statistical Significance
0.2429
Supporting Reference Compounds
40
E-value
1891.19
Lysophosphatidic acid receptor 1 structureClick to view 3D structureLysophosphatidic acid receptor 1Q92633HumansPredicted (SEA)
Prediction Confidence Score
0.169
Applicability Domain
0.238 Low confidence
Statistical Significance
0.3627
Supporting Reference Compounds
31
E-value
2823.44
Liver carboxylesterase structureClick to view 3D structureLiver carboxylesteraseQ29550Sus scrofaPredicted (SEA)
Prediction Confidence Score
0.167
Applicability Domain
0.237 Low confidence
Statistical Significance
0.1187
Supporting Reference Compounds
20
E-value
924.382
Click to view 3D structureSucrase-isomaltaseB5THE3Mus musculusPredicted (SEA)
Prediction Confidence Score
0.166
Applicability Domain
0.188 Low confidence
Statistical Significance
0.0076
Supporting Reference Compounds
7
E-value
58.9319
Peroxisome proliferator-activated receptor alpha structureClick to view 3D structurePeroxisome proliferator-activated receptor alphaQ07869HumansPredicted (SEA)
Prediction Confidence Score
0.165
Applicability Domain
0.208 Low confidence
Statistical Significance
0.7913
Supporting Reference Compounds
127
E-value
6160.6
Click to view 3D structureCG8425-PA [Drosophila melanogaster]A1ZA98Drosophila melanogasterPredicted (SEA)
Prediction Confidence Score
0.165
Applicability Domain
0.237 Low confidence
Statistical Significance
0.0095
Supporting Reference Compounds
4
E-value
73.8789
Neutrophil collagenase structureClick to view 3D structureNeutrophil collagenaseP22894HumansPredicted (SEA)
Prediction Confidence Score
0.163
Applicability Domain
0.234 Low confidence
Statistical Significance
0.7986
Supporting Reference Compounds
176
E-value
6217.43
Click to view 3D structureLysophosphatidic acid receptor 4Q99677HumansPredicted (SEA)
Prediction Confidence Score
0.163
Applicability Domain
0.238 Low confidence
Statistical Significance
0.0365
Supporting Reference Compounds
9
E-value
284.072
Peroxisome proliferator-activated receptor delta structureClick to view 3D structurePeroxisome proliferator-activated receptor deltaQ03181HumansPredicted (SEA)
Prediction Confidence Score
0.162
Applicability Domain
0.208 Low confidence
Statistical Significance
0.7873
Supporting Reference Compounds
89
E-value
6128.84
Click to view 3D structureBeta-1 adrenergic receptorB0FL73Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.161
Applicability Domain
0.18 Low confidence
Statistical Significance
0.3029
Supporting Reference Compounds
37
E-value
2358.13
Click to view 3D structureBeta-2 adrenergic receptorQ8K4Z4Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.16
Applicability Domain
0.18 Low confidence
Statistical Significance
0.413
Supporting Reference Compounds
48
E-value
3215.33
Click to view 3D structureBeta-1 adrenergic receptorP18090Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.16
Applicability Domain
0.163 Low confidence
Statistical Significance
0.4942
Supporting Reference Compounds
43
E-value
3847.62
Matrix metalloproteinase-14 structureClick to view 3D structureMatrix metalloproteinase-14P50281HumansPredicted (SEA)
Prediction Confidence Score
0.159
Applicability Domain
0.234 Low confidence
Statistical Significance
0.8846
Supporting Reference Compounds
198
E-value
6886.85
5-hydroxytryptamine receptor 2C structureClick to view 3D structure5-hydroxytryptamine receptor 2CP28335HumansPredicted (SEA)
Prediction Confidence Score
0.159
Applicability Domain
0.182 Low confidence
Statistical Significance
0.9854
Supporting Reference Compounds
823
E-value
7671.42
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available