1-Ethoxy-2,2,3,3,4,4,4-heptafluorobutan-1-ol (CED0188714)

Record Information

Version

1.0

Creation Date

2026-04-04 18:45:36 UTC

Update Date

2026-08-23 13:56:27 UTC

SynCED ID

CED0188714

Secondary Accession Numbers

CHEM078061

Identification

Common Name

1-Ethoxy-2,2,3,3,4,4,4-heptafluorobutan-1-ol

Class

Small Molecule

Description

1-Ethoxy-2,2,3,3,4,4,4-heptafluorobutan-1-ol is an organic compound with the chemical formula C6H7F7O2 and an average molecular weight of 244.11 g/mol. 1-Ethoxy-2,2,3,3,4,4,4-heptafluorobutan-1-ol belongs to the fluorohydrins, a subclass of halohydrins within the organic compounds. This substance is found in or released from 13 recorded sources across several sectors. In the electrical and electronic equipment sector, 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, and in medical devices within the healthcare, pharmaceuticals and veterinary products sector. Additionally, the compound is used as lubricants in both the energy, oil and gas sector and the industrial manufacturing and chemical processing sector, as well as in one other sector. Recorded routes of exposure for this compound include oral, inhalation, and touch.

Contaminant Type

PFAS

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₆H₇F₇O₂

Average Molecular Mass

244.109 g/mol

Monoisotopic Mass

244.033 g/mol

CAS Registry Number

356-26-3

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CCOC(O)C(F)(F)C(F)(F)C(F)(F)F

InChI Identifier

InChI=1/C6H7F7O2/c1-2-15-3(14)4(7,8)5(9,10)6(11,12)13/h3,14H,2H2,1H3

InChI Key

NPUHUJNJOILQJC-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
1450.0 Log mg/kg [820:2600]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000007	Pesticides?Pesticides are synthetic chemicals designed to prevent, destroy, or control pests that threaten crops and agricultural productivity.	Agriculture & land management	Not Available
CEDs000120	Wires and cables?Wires and cables are integral components in the transmission of electrical power and signals.	Electrical & Electronic Equipment	Not Available
CEDs000121	Printed 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 Equipment	Not Available
CEDs000125	Batteries?Batteries are devices that store and release electrical energy through electrochemical reactions.	Electrical & Electronic Equipment	Not Available
CEDs000130	Semiconductors?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 Equipment	Not Available
CEDs000138	Lubricants?Lubricants are synthetic or petroleum-derived substances used to reduce friction between surfaces in machinery and equipment, enhancing operational efficiency and longevity.	Energy, oil & gas	Not Available
CEDs000147	Food packaging?Food packaging often utilizes synthetic chemicals, such as plastics and coatings, to enhance durability, moisture resistance, and shelf life.	Food, food processing & cookware	Not Available
CEDs000174	Lubricants?Lubricants are synthetic or petroleum-based substances used to reduce friction and wear between moving parts in machinery and equipment.	Industrial manufacturing & chemical processing	Not Available
CEDs000234	Medical devices?Medical devices often incorporate synthetic chemicals in their manufacturing processes, which can contribute to contamination in healthcare settings.	Healthcare, pharmaceuticals & veterinary products	Not Available
CEDs000451	Carpets 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 & furnishings	Not Available
CEDs000454	Synthetic 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 & furnishings	Not Available
CEDs000490		Personal care & cosmetics	Not Available
CEDs000492	Cell phones?Cell phones contain a variety of synthetic chemicals and materials, including plastics, metals, and glass, which can contribute to environmental contamination.	Electrical & Electronic Equipment	Not Available
CEDs000493	Capacitors?Capacitors are electronic components that store and release electrical energy, often using dielectric materials that can include synthetic chemicals.	Electrical & Electronic Equipment	Not Available

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Liver carboxylesterase	Q29550	Sus scrofa	Predicted (SEA)	Prediction Confidence Score 0.197 Applicability Domain 0.205 Low confidence Statistical Significance 0.0242 Supporting Reference Compounds 20 E-value 188.162
Click to view 3D structure	Liver carboxylesterase 1	P23141	Humans	Predicted (SEA)	Prediction Confidence Score 0.197 Applicability Domain 0.204 Low confidence Statistical Significance 0.1074 Supporting Reference Compounds 55 E-value 836.334
Click to view 3D structure	Cocaine esterase	O00748	Humans	Predicted (SEA)	Prediction Confidence Score 0.195 Applicability Domain 0.205 Low confidence Statistical Significance 0.0748 Supporting Reference Compounds 40 E-value 582.546
Click to view 3D structure	Acylcarnitine hydrolase	Q91WG0	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.188 Applicability Domain 0.205 Low confidence Statistical Significance 0.0054 Supporting Reference Compounds 2 E-value 42.2721
Click to view 3D structure	CG8425-PA [Drosophila melanogaster]	A1ZA98	Drosophila melanogaster	Predicted (SEA)	Prediction Confidence Score 0.185 Applicability Domain 0.205 Low confidence Statistical Significance 0.0057 Supporting Reference Compounds 4 E-value 44.4519
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.204 Low confidence Statistical Significance 0.8199 Supporting Reference Compounds 406 E-value 6383.09
Click to view 3D structure	Beta-2 adrenergic receptor	Q8K4Z4	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.183 Applicability Domain 0.196 Low confidence Statistical Significance 0.1619 Supporting Reference Compounds 48 E-value 1260.46
Click to view 3D structure	Juvenile hormone esterase	Q9GPG0	Manduca sexta	Predicted (SEA)	Prediction Confidence Score 0.183 Applicability Domain 0.194 Low confidence Statistical Significance 0.0059 Supporting Reference Compounds 2 E-value 46.0867
Click to view 3D structure	Beta-1 adrenergic receptor	B0FL73	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.181 Applicability Domain 0.196 Low confidence Statistical Significance 0.1344 Supporting Reference Compounds 37 E-value 1046.06
Click to view 3D structure	Liver carboxylesterase B-1	Q63010	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.18 Applicability Domain 0.195 Low confidence Statistical Significance 0.0041 Supporting Reference Compounds 6 E-value 32.0739
Click to view 3D structure	Fatty-acid amide hydrolase 1	O00519	Humans	Predicted (SEA)	Prediction Confidence Score 0.18 Applicability Domain 0.194 Low confidence Statistical Significance 0.6634 Supporting Reference Compounds 106 E-value 5164.83
Click to view 3D structure	Inositol hexakisphosphate and diphosphoinositol-pentakisphosphate kinase 2	O43314	Humans	Predicted (SEA)	Prediction Confidence Score 0.18 Applicability Domain 0.18 Low confidence Statistical Significance 9.40e-04 Supporting Reference Compounds 1 E-value 7.31783
Click to view 3D structure	Protein RecA	P9WHJ3	Mycobacterium tuberculosis	Predicted (SEA)	Prediction Confidence Score 0.172 Applicability Domain 0.19 Low confidence Statistical Significance 0.8266 Supporting Reference Compounds 296 E-value 6434.94
Click to view 3D structure	Voltage-gated potassium channel KCNC1	P25122	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.17 Applicability Domain 0.17 Low confidence Statistical Significance 0.0297 Supporting Reference Compounds 1 E-value 231.212
Click to view 3D structure	Sodium-dependent serotonin transporter	P31645	Humans	Predicted (SEA)	Prediction Confidence Score 0.169 Applicability Domain 0.184 Low confidence Statistical Significance 0.959 Supporting Reference Compounds 593 E-value 7465.58
Click to view 3D structure	Sodium-dependent noradrenaline transporter	P23975	Humans	Predicted (SEA)	Prediction Confidence Score 0.169 Applicability Domain 0.184 Low confidence Statistical Significance 0.9526 Supporting Reference Compounds 451 E-value 7415.61
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.184 Low confidence Statistical Significance 0.9893 Supporting Reference Compounds 1498 E-value 7701.39
Click to view 3D structure	Alpha-2A adrenergic receptor	P08913	Humans	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.184 Low confidence Statistical Significance 0.9603 Supporting Reference Compounds 487 E-value 7475.78
Click to view 3D structure	DNA damage-inducible transcript 3 protein	P35639	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.19 Low confidence Statistical Significance 0.8505 Supporting Reference Compounds 226 E-value 6620.77
Click to view 3D structure	X-box-binding protein 1	P17861	Humans	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.19 Low confidence Statistical Significance 0.851 Supporting Reference Compounds 227 E-value 6625.36
Click to view 3D structure	Esterase	A3QR02	Chilo suppressalis	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.167 Low confidence Statistical Significance 0.0032 Supporting Reference Compounds 1 E-value 25.1453
Click to view 3D structure	5-hydroxytryptamine receptor 2C	P28335	Humans	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.184 Low confidence Statistical Significance 0.9758 Supporting Reference Compounds 823 E-value 7596.29
Click to view 3D structure	Sodium-dependent serotonin transporter	P31652	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.165 Applicability Domain 0.184 Low confidence Statistical Significance 0.8723 Supporting Reference Compounds 297 E-value 6790.55
Click to view 3D structure	Sodium-dependent dopamine transporter	P23977	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.164 Applicability Domain 0.184 Low confidence Statistical Significance 0.7473 Supporting Reference Compounds 203 E-value 5817.36
Click to view 3D structure	Muscarinic acetylcholine receptor M5	P08912	Humans	Predicted (SEA)	Prediction Confidence Score 0.164 Applicability Domain 0.184 Low confidence Statistical Significance 0.9314 Supporting Reference Compounds 266 E-value 7251.11