Mrv0541 02241204562D          

  5  4  0  0  0  0            999 V2000
    2.0625   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8250   -1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Hg  0  3  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
M  CHG  2   2   1   5   1
M  END
> <DATABASE_ID>
T3D0354

> <DATABASE_NAME>
t3db

> <SMILES>
O[N+](=O)O[Hg+]

> <INCHI_IDENTIFIER>
InChI=1S/Hg.HNO3/c;2-1(3)4/h;(H,2,3,4)/q+2;

> <INCHI_KEY>
QTOJKJUNKHDTGB-UHFFFAOYSA-N

> <FORMULA>
HHgNO3

> <MOLECULAR_WEIGHT>
263.6

> <EXACT_MASS>
264.966268507

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
5.500128191202494

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
2

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-hydroxy-1,3-dioxa-2-aza-4-mercurabut-1-en-2-ium-4-ylium

> <JCHEM_LOGP>
-2.2807742410887166

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_ACIDIC>
-12.528874840927763

> <JCHEM_PKA_STRONGEST_BASIC>
-6.866685008737677

> <JCHEM_POLAR_SURFACE_AREA>
49.540000000000006

> <JCHEM_REFRACTIVITY>
9.376100000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
2-hydroxy-1,3-dioxa-2-aza-4-mercurabut-1-en-2-ium-4-ylium

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D0354

> <NAME>
Mercury(II) nitrate

> <CAS>
10045-94-0

> <SYNONYMS>
Mercuric nitrate; Mercury dinitrate; Mercury nitrate; Mercury(II) nitric acid

> <TYPES>
Inorganic Compound; Mercury Compound; Nitrite; Nitrate; Pollutant; Industrial/Workplace Toxin; Synthetic Compound

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