Mrv0541 02241205192D          

  7  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0018    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0036    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0018   -1.6500    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    2.0036   -1.6500    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.3000    0.0000 Zn  0  2  0  0  0  0  0  0  0  0  0  0
M  CHG  7   1  -1   2  -1   3  -1   4  -1   5   1   6   1   7   2
M  END
> <DATABASE_ID>
T3D1469

> <DATABASE_NAME>
t3db

> <SMILES>
[OH-].[OH-].[OH-].[OH-].[Na+].[Na+].[Zn++]

> <INCHI_IDENTIFIER>
InChI=1S/2Na.4H2O.Zn/h;;4*1H2;/q2*+1;;;;;+2/p-4

> <INCHI_KEY>
HVTHJRMZXBWFNE-UHFFFAOYSA-J

> <FORMULA>
H4Na2O4Zn

> <MOLECULAR_WEIGHT>
179.418

> <EXACT_MASS>
177.919644544

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
1.1909242651253518

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
zinc(2+) ion disodium tetrahydroxide

> <JCHEM_LOGP>
-0.6519999999999999

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.7

> <JCHEM_PKA_STRONGEST_BASIC>
-1.7999999999999998

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
13.914900000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
zinc(2+) ion disodium tetrahydroxide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1469

> <NAME>
Sodium zincate

> <CAS>
12179-14-5

> <SYNONYMS>
Disodium tetrahydroxyzincate; Sodium zinc hydroxide; Sodium zincic acid

> <TYPES>
Inorganic Compound; Zinc Compound; Industrial/Workplace Toxin; Synthetic Compound

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