Marvin  01300812142D          

  3  2  0  0  0  0            999 V2000
    0.2145    0.8375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5000    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2145    0.8375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  2  3  1  0  0  0  0
M  END
> <ID>
CHEBI:48397

> <NAME>
methanediol

> <DEFINITION>
The simplest member of the class of methanediols that is methane in which two of the hydrogens have been substituted by hydroxy groups.

> <STAR>
3

> <SYNONYM>
Methylene glycol; Methandiol; formaldehyde hydrate; dihydroxymethane

> <IUPAC_NAME>
methanediol

> <FORMULA>
CH4O2

> <MASS>
48.04126

> <MONOISOTOPIC_MASS>
48.02113

> <CHARGE>
0

> <SMILES>
OCO

> <INCHI>
InChI=1S/CH4O2/c2-1-3/h2-3H,1H2

> <INCHIKEY>
CKFGINPQOCXMAZ-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1730798

> <CAS_REGISTRY_NUMBER>
463-57-0

> <REAXYS_REGISTRY_NUMBER>
1730798

> <CHEMIDPLUS>
463-57-0

> <NIST_CHEMISTRY_WEBBOOK>
463-57-0

> <WIKIPEDIA_ACCESSION>
Methanediol

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