Basic information
- CAS
4353-28-0- Standard SMILES
CCOCCOCCOCCOCCOCC- InChIKey
HYDWALOBQJFOMS-UHFFFAOYSA-N- Molecular formula
- C12H26O5
- Average molar mass
- 250.33 g/mol
- Monoisotopic mass
- 250.17802393
Overview
3,6,9,12,15-pentaoxaheptadecane is a polyether.
Names & identifiers
- Preferred name
- 3,6,9,12,15-Pentaoxaheptadecane
- IUPAC
- 1-ethoxy-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethane
- English name
- 3,6,9,12,15-pentaoxaheptadecane
- Molecular formula
- C12H26O5
- Molecular weight
- 250.33
Names & synonyms
3,6,9,12,15-PentaoxaheptadecaneTetraethylene glycol diethyl etherEINECS 224-423-7Ether, bis(2-(2-ethoxyethoxy)ethyl)XO8API468SBRN 1767873bis(2-(2-ethoxyethoxy)ethyl) etherUNII-XO8API468S1-ethoxy-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethaneDTXSID0052099CHEBI:447514-01-00-02404 (Beilstein Handbook Reference)
Show more names
CH3CH2O-PEG4-CH2CH3Diethoxytetraethylene glycolGlycol, diethoxytetraethyleneDiethylether tetraethylenglykoluDiethylether tetraethylenglykolu [czech]
1-ETHOXY-2-(2-(2-(2-ETHOXYETHOXY)ETHOXY)ETHOXY)ETHANERefChem:91686DTXCID50306663,6,9,12,15PentaoxaheptadecaneEther, bis(2(2ethoxyethoxy)ethyl)224-423-7HYDWALOBQJFOMS-UHFFFAOYSA-N4353-28-0
Database identifiers
- CAS
4353-28-0- PubChem CID
- 78057
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 14
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 118
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
SolventsSolvents -> Glycol Ethers (Glymes)
Physical DescriptionColorless liquid; [Sigma-Aldrich MSDS]
Physicochemical properties
- Boiling point
- 313.46 °C · 313.46°C (rough estimate)
- Density
- 1.0187 · 1.0187 (rough estimate)
- refractive index
- 1.456 · 1.4560 (estimate)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 8 API468S · XO8API468S
- EPA Substance Registry System
- 3 · 3,6,9,12,15-Pentaoxaheptadecane (4353-28-0)
- TSCA
- TSCA listed
- Toxicity
- 50 orl-rat: · LD50 orl-rat: 4290 mg/kg AIHAAP30,470,69
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
Chemical: 3,6,9,12,15-Pentaoxaheptadecane
SP - indicates a substance that is identified in a proposed Significant New Use Rule.
3,6,9,12,15-Pentaoxaheptadecane: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards SummaryForms explosive peroxides on prolonged storage; May cause irritation; [Sigma-Aldrich MSDS] See Monoglyme.
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Safety data
- tsca
- TSCA listed
- Toxicity
- LD50 orl-rat: 4290 mg/kg AIHAAP30,470,69
Chemistry & industry
Uses & manufacturing
Household ProductsInformation on 1 consumer products that contain Tetraethylene glycol diethyl ether in the following categories is provided:
General Manufacturing Information3,6,9,12,15-Pentaoxaheptadecane: ACTIVE
Suppliers5 total
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
安那莱（齐河）新材料科技有限公司18600642180（微信同） 13391601435 · [email protected]
西安康福诺生物科技有限公司+86-156-80926068 +86-15680926068 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
河南梦泰医药科技有限公司17634413542 · [email protected]
Additional notes
DefinitionChEBI: 3,6,9,12,15-pentaoxaheptadecane is a polyether.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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