Mrv0541 02241205272D          

 11  8  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0
    2.8286   -0.8250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.8286    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.8286    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6536    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0036    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -4.1250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.3000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  2  0  0  0  0
  3  6  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  2  0  0  0  0
  8 11  2  0  0  0  0
M  CHG  3   1   2   2  -1   7  -1
M  END
> <DATABASE_ID>
T3D1912

> <DATABASE_NAME>
t3db

> <SMILES>
[Mg++].[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/2ClHO4.Mg/c2*2-1(3,4)5;/h2*(H,2,3,4,5);/q;;+2/p-2

> <INCHI_KEY>
MPCRDALPQLDDFX-UHFFFAOYSA-L

> <FORMULA>
Cl2MgO8

> <MOLECULAR_WEIGHT>
223.206

> <EXACT_MASS>
221.882064288

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
5.233355042576066

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
magnesium(2+) ion diperchlorate

> <JCHEM_LOGP>
-0.09765369733333332

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
-6.891996239864091

> <JCHEM_POLAR_SURFACE_AREA>
74.27

> <JCHEM_REFRACTIVITY>
11.9079

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
magnesium(2+) ion diperchlorate

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D1912

> <NAME>
Magnesium perchlorate

> <CAS>
10034-81-8

> <SYNONYMS>
Anhydrone; Anhydrous magnesium perchlorate; Dehydrite; Magnesium perchlorate hydrate; Magnesium perchloric acid; Perchloric acid, magnesium salt

> <TYPES>
Inorganic Compound; Food Toxin; Perchlorate; Lachrymator; Synthetic Compound

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