MXE

2-METHOXYETHANOL

Created: 2003-06-06
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count0
Bond Count12
Aromatic Bond Count0
2D diagram of MXE

Chemical Component Summary

Name2-METHOXYETHANOL
Systematic Name (OpenEye OEToolkits)2-methoxyethanol
FormulaC3 H8 O2
Molecular Weight76.094
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04OCCOC
SMILESCACTVS3.341COCCO
SMILESOpenEye OEToolkits1.5.0COCCO
Canonical SMILESCACTVS3.341 COCCO
Canonical SMILESOpenEye OEToolkits1.5.0 COCCO
InChIInChI1.03 InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3
InChIKeyInChI1.03 XNWFRZJHXBZDAG-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB02806 
Name2-Methoxyethanol
Groups experimental
Synonyms2-Methoxyethanol
Categories
  • Alcohols
  • Glycols
  • Immunologic Factors
  • Immunosuppressive Agents
  • Noxae
CAS number109-86-4

Related Resource References

Resource NameReference
PubChem 8019
ChEMBL CHEMBL444144
ChEBI CHEBI:53449, CHEBI:46790
CCDC/CSD ARAXUM, JOZCAC, VIXHEP, HERCEN, ADOXAS, YOQFER