12P

DODECAETHYLENE GLYCOL

Created:	2004-06-15
Last modified:	2021-03-01

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Chemical Details
Formal Charge	0
Atom Count	87
Chiral Atom Count	0
Bond Count	86
Aromatic Bond Count	0

2D diagram of 12P

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Chemical Component Summary
Name	DODECAETHYLENE GLYCOL
Synonyms	POLYETHYLENE GLYCOL PEG400
Systematic Name (OpenEye OEToolkits)	2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Formula	C₂₄ H₅₀ O₁₃
Molecular Weight	546.646
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O(CCOCCOCCOCCOCCO)CCOCCOCCOCCOCCOCCOCCO
SMILES	CACTVS	3.341	OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
SMILES	OpenEye OEToolkits	1.5.0	C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
Canonical SMILES	CACTVS	3.341	OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
InChI	InChI	1.03	InChI=1S/C24H50O13/c25-1-3-27-5-7-29-9-11-31-13-15-33-17-19-35-21-23-37-24-22-36-20-18-34-16-14-32-12-10-30-8-6-28-4-2-26/h25-26H,1-24H2
InChIKey	InChI	1.03	WRZXKWFJEFFURH-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	81248
ChEBI	CHEBI:39524

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