Triethylene glycol

CAT: 1489-T7280-01Size: 500 mLDry Ice: NoHazardous: No

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CAT#:1489-T7280-01Size:500 mL

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CAS Number

112-27-6

Purity

0.99

Chemical Information

Triethylene Glycol

Triethylene glycol is a poly(ethylene glycol) that is octane-1,8-diol in which the carbon atoms at positions 3 and 6 have been replaced by oxygen atoms. It has a role as a plasticiser. It is a primary alcohol, a diol and a poly(ethylene glycol).

CAS Number	112-27-6
PubChem CID	8172
IUPAC Name	2-[2-(2-hydroxyethoxy)ethoxy]ethanol
Molecular Formula	C6H14O4
Molecular Weight	150.17
XLogP	-1.6
Topological Polar Surface Area	58.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Heavy Atom Count	10
Formal Charge	0
Complexity	49

SMILES

C(COCCOCCO)O

InChI

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

InChIKey

ZIBGPFATKBEMQZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 112-27-6

CID: 8172

Formula: C6H14O4

MW: 150.17

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	150.17
XLogP3	-1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	150.08920892
Monoisotopic Mass	150.08920892
Topological Polar Surface Area	58.9 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	49.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Triethylene glycol

Chemical Information

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