Marvin  07160711272D          

 19 18  0  0  0  0            999 V2000
   -0.7622    0.7622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7622   -0.7622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.9029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9029    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.9029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0779    0.0000 B   0  5  3  0  0  0  0  0  0  0  0  0
    1.0779    0.0000    0.0000 B   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0779    0.0000 B   0  5  3  0  0  0  0  0  0  0  0  0
   -1.0780    0.0000    0.0000 B   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7622    0.7622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7622   -0.7622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9030    1.4289    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
   -1.9030   -1.4289    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.7144    2.3154    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3154   -0.7145    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.3154    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3155    0.7145    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9030    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  9  1  1  0  0  0  0
  6  1  1  0  0  0  0
 11  6  1  0  0  0  0
  7 11  1  0  0  0  0
  6  3  1  0  0  0  0
  9 12  1  0  0  0  0
  8 12  1  0  0  0  0
  2  8  1  0  0  0  0
  7  2  1  0  0  0  0
  8  5  1  0  0  0  0
  9 19  1  0  0  0  0
  7  4  1  0  0  0  0
 19 18  1  0  0  0  0
  3 15  1  0  0  0  0
  4 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6 10  1  0  0  0  0
  8 10  1  0  0  0  0
M  CHG  4   6  -1   8  -1  13   1  14   1
M  END
> <ID>
CHEBI:38892

> <NAME>
disodium tetraborate

> <STAR>
3

> <SYNONYM>
sodium tetraborate; sodium borate anhydrous; disodium tetraborate, anhydrous; disodium tetraborate; anhydrous borax

> <IUPAC_NAME>
sodium 1,3,5,7-tetrahydroxybicyclo[3.3.1]tetraboroxane-1,5-diide

> <FORMULA>
B4H4Na2O9

> <MASS>
237.24990

> <MONOISOTOPIC_MASS>
238.00229

> <CHARGE>
0

> <SMILES>
[Na+].[Na+].[H]OB1O[B-]2(O[H])OB(O[H])O[B-](O[H])(O1)O2

> <INCHI>
InChI=1S/B4H4O9.2Na/c5-1-9-3(7)11-2(6)12-4(8,10-1)13-3;;/h5-8H;;/q-2;2*+1

> <INCHIKEY>
LVSJLTMNAQBTPE-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
1330-43-4

> <GMELIN_REGISTRY_NUMBER>
23561

> <CHEMIDPLUS>
1330-43-4

> <NIST_CHEMISTRY_WEBBOOK>
1330-43-4

> <WIKIPEDIA_ACCESSION>
Borax

$$$$