triethylene glycol (CHEBI:44926)

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CHEBI:44926 - triethylene glycol

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ChEBI Name	triethylene glycol

ChEBI ID	CHEBI:44926

Definition	A poly(ethylene glycol) that is octane-1,8-diol in which the carbon atoms at positions 3 and 6 have been replaced by oxygen atoms.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	No supplier information found for this compound.

Download	Molfile XML SDF

more structures >>

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24 23 0 0 0 0 999 V2000

-3.4526 1.9787 -0.9225 O 0 0 0 0 0 0 0 0 0 0 0 0

-3.0676 2.0008 0.4526 C 0 0 0 0 0 0 0 0 0 0 0 0

-2.5781 0.6121 0.8679 C 0 0 0 0 0 0 0 0 0 0 0 0

-1.4544 0.2438 0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0

-1.0466 -1.0553 0.4976 C 0 0 0 0 0 0 0 0 0 0 0 0

0.1591 -1.5115 -0.3259 C 0 0 0 0 0 0 0 0 0 0 0 0

1.2348 -0.5886 -0.1464 O 0 0 0 0 0 0 0 0 0 0 0 0

2.3253 -1.0673 -0.9368 C 0 0 0 0 0 0 0 0 0 0 0 0

3.5167 -0.1207 -0.7885 C 0 0 0 0 0 0 0 0 0 0 0 0

3.9123 -0.0635 0.5825 O 0 0 0 0 0 0 0 0 0 0 0 0

-3.7536 2.8709 -1.1422 H 0 0 0 0 0 0 0 0 0 0 0 0

4.6637 0.5429 0.6315 H 0 0 0 0 0 0 0 0 0 0 0 0

-2.2659 2.7255 0.5947 H 0 0 0 0 0 0 0 0 0 0 0 0

-3.9247 2.2820 1.0655 H 0 0 0 0 0 0 0 0 0 0 0 0

-2.2842 0.6286 1.9172 H 0 0 0 0 0 0 0 0 0 0 0 0

-3.3798 -0.1126 0.7258 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.7721 -1.0176 1.5525 H 0 0 0 0 0 0 0 0 0 0 0 0

-1.8667 -1.7592 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0

0.4700 -2.5021 0.0047 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.1153 -1.5491 -1.3798 H 0 0 0 0 0 0 0 0 0 0 0 0

2.6096 -2.0638 -0.5985 H 0 0 0 0 0 0 0 0 0 0 0 0

2.0232 -1.1114 -1.9829 H 0 0 0 0 0 0 0 0 0 0 0 0

4.3487 -0.4857 -1.3909 H 0 0 0 0 0 0 0 0 0 0 0 0

3.2323 0.8757 -1.1268 H 0 0 0 0 0 0 0 0 0 0 0 0

1 2 1 0 0 0 0

1 11 1 0 0 0 0

2 3 1 0 0 0 0

2 13 1 0 0 0 0

2 14 1 0 0 0 0

3 4 1 0 0 0 0

3 15 1 0 0 0 0

3 16 1 0 0 0 0

4 5 1 0 0 0 0

5 6 1 0 0 0 0

5 17 1 0 0 0 0

5 18 1 0 0 0 0

6 7 1 0 0 0 0

6 19 1 0 0 0 0

6 20 1 0 0 0 0

7 8 1 0 0 0 0

8 9 1 0 0 0 0

8 21 1 0 0 0 0

8 22 1 0 0 0 0

9 10 1 0 0 0 0

9 23 1 0 0 0 0

9 24 1 0 0 0 0

10 12 1 0 0 0 0

M END): 17 ms

reading 24 atoms

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Wikipedia	License
Triethylene glycol, TEG, or triglycol is a colorless odorless viscous liquid with molecular formula HOCH2CH2OCH2CH2OCH2CH2OH. It is used as a plasticizer for vinyl polymers. It is also used in air sanitizer products, such as "Oust" or "Clean and Pure". When aerosolized it acts as a disinfectant. Glycols are also used as liquid desiccants for natural gas and in air conditioning systems. It is an additive for hydraulic fluids and brake fluids and is used as a base for "smoke machine" fluid in the entertainment industry.
Read full article at Wikipedia

Formula

C6H14O4

Net Charge

Average Mass

150.17296

Monoisotopic Mass

150.08921

InChI

InChI=1S/C6H14O4/c7-1-3-9-5-6-10-4-2-8/h7-8H,1-6H2

InChIKey

ZIBGPFATKBEMQZ-UHFFFAOYSA-N

SMILES

OCCOCCOCCO

Roles Classification
Application(s):	plasticiser Any compound that is used as an additive to increase the plasticity or fluidity of a substance, particularly but not exclusively to synthetic polymers.

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	triethylene glycol (CHEBI:44926) has role plasticiser (CHEBI:79056) triethylene glycol (CHEBI:44926) is a diol (CHEBI:23824) triethylene glycol (CHEBI:44926) is a poly(ethylene glycol) (CHEBI:46793) triethylene glycol (CHEBI:44926) is a primary alcohol (CHEBI:15734)

Incoming	triethylene glycol monomethyl ether (CHEBI:84233) has functional parent triethylene glycol (CHEBI:44926)

IUPAC Name

2,2'-[ethane-1,2-diylbis(oxy)]diethanol

Synonyms	Sources
1,2-bis(2-hydroxyethoxy)ethane	ChemIDplus
2,2'-ethylenedioxybis(ethanol)	ChemIDplus
2,2'-ethylenedioxydiethanol	ChemIDplus
2-[2-(2-HYDROXY-ETHOXY)-ETHOXY]-ETHANOL	PDBeChem
2-[2-(2-hydroxyethoxy)ethoxy]ethanol	NIST Chemistry WebBook
3,6-dioxaoctane-1,8-diol	NIST Chemistry WebBook
di-β-hydroxyethoxyethane	NIST Chemistry WebBook
TEG	ChemIDplus
Triethylene glycol	ChemIDplus
Triethylenglykol	NIST Chemistry WebBook
triglycol	ChEBI

Manual Xrefs	Databases
DB02327	DrugBank
PGE	PDBeChem
Triethylene_glycol	Wikipedia
View more database links

Registry Numbers	Types	Sources
112-27-6	CAS Registry Number	ChemIDplus
112-27-6	CAS Registry Number	NIST Chemistry WebBook
260942	Gmelin Registry Number	Gmelin
969357	Reaxys Registry Number	Reaxys

Citation

Teamkao P, Thiravetyan P (2015)
Phytoremediation of Mono-, Di-, and Triethylene Glycol by Echinodorus cordifolius L. Griseb.
International journal of phytoremediation 17, 93-100 [PubMed:25174429]
[show Abstract]

Last Modified

20 November 2019

CHEBI:44926 - triethylene glycol

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