P4C

O-ACETALDEHYDYL-HEXAETHYLENE GLYCOL

Created: 1999-07-08
Last modified:  2021-03-01

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Chemical Details

Formal Charge0
Atom Count50
Chiral Atom Count0
Bond Count49
Aromatic Bond Count0
2D diagram of P4C

Chemical Component Summary

NameO-ACETALDEHYDYL-HEXAETHYLENE GLYCOL
SynonymsPOLYETHYLENE 400
Systematic Name (OpenEye OEToolkits)2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanal
FormulaC14 H28 O8
Molecular Weight324.367
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=CCOCCOCCOCCOCCOCCOCCO
SMILESCACTVS3.341OCCOCCOCCOCCOCCOCCOCC=O
SMILESOpenEye OEToolkits1.5.0C(COCCOCCOCCOCCOCCOCC=O)O
Canonical SMILESCACTVS3.341 OCCOCCOCCOCCOCCOCCOCC=O
Canonical SMILESOpenEye OEToolkits1.5.0 C(COCCOCCOCCOCCOCCOCC=O)O
InChIInChI1.03 InChI=1S/C14H28O8/c15-1-3-17-5-7-19-9-11-21-13-14-22-12-10-20-8-6-18-4-2-16/h1,16H,2-14H2
InChIKeyInChI1.03 CTLLATPOKUEFSQ-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 449607
ChEBI CHEBI:44758