Mrv0541 02241216572D          

 12  9  0  0  0  0            999 V2000
   -2.1863   -0.9075    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5362   -0.7425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3613    0.0825    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.5362    0.0825    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5362    0.9075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2888    0.0825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1138    0.0825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9388   -0.7425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9388    0.9075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9388    0.0825    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.7638    0.0825    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.7638   -0.3292    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
  2  4  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7 10  1  0  0  0  0
  8 10  2  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
M  CHG  4   1   1   3  -1  11  -1  12   1
M  END
> <DATABASE_ID>
FDB015407

> <DATABASE_NAME>
foodb

> <SMILES>
[K+].[K+].[O-]S(=O)(=O)OOS([O-])(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/2K.H2O8S2/c;;1-9(2,3)7-8-10(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2

> <INCHI_KEY>
USHAGKDGDHPEEY-UHFFFAOYSA-L

> <FORMULA>
K2O8S2

> <MOLECULAR_WEIGHT>
270.322

> <EXACT_MASS>
269.830872078

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_AVERAGE_POLARIZABILITY>
11.732096028039393

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dipotassium O-[(sulfonatoperoxy)sulfonyl]oxidanidolate

> <JCHEM_LOGP>
-0.9336957733333332

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
-2.7744508010456945

> <JCHEM_PKA_STRONGEST_ACIDIC>
-3.475241414284997

> <JCHEM_POLAR_SURFACE_AREA>
132.85999999999999

> <JCHEM_REFRACTIVITY>
22.869400000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
dipotassium peroxydisulfate

> <JCHEM_VEBER_RULE>
0

> <FOODB_ID>
FDB015407

> <GENERIC_NAME>
Potassium persulfate (K2S2O8)

$$$$