Marvin  10080712212D          

  6  5  0  0  0  0            999 V2000
    1.7862    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3572   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0717    0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
M  END
> <ID>
CHEBI:42263

> <NAME>
1,2-dimethoxyethane

> <DEFINITION>
A diether that is the 1,2-dimethyl ether of ethane-1,2-diol.

> <STAR>
3

> <SYNONYM>
monoglyme; glyme; Ethylenglykoldimethylether; Ethylenglycoldimethylether; ethylene glycol dimethyl ether; Egdme; dme; DME; Dimethyl Cellosolve; CH3OCH2CH2OCH3; alpha,beta-dimethoxyethane; 2,5-dioxahexane; 1,2-DIMETHOXYETHANE; 1,2-Dimethoxyethan

> <IUPAC_NAME>
1,2-dimethoxyethane

> <FORMULA>
C4H10O2

> <MASS>
90.12100

> <MONOISOTOPIC_MASS>
90.06808

> <CHARGE>
0

> <SMILES>
COCCOC

> <INCHI>
InChI=1S/C4H10O2/c1-5-3-4-6-2/h3-4H2,1-2H3

> <INCHIKEY>
XTHFKEDIFFGKHM-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
110-71-4

> <GMELIN_REGISTRY_NUMBER>
1801

> <REAXYS_REGISTRY_NUMBER>
1209237

> <CHEMIDPLUS>
110-71-4

> <NIST_CHEMISTRY_WEBBOOK>
110-71-4

> <PDBECHEM_ACCESSION>
DXE

> <WIKIPEDIA_ACCESSION>
1,2-dimethoxyethane

> <PUBMED_CITATION>
15515094; 18465765

$$$$