Mrv0541 02241205062D          

  3  2  0  0  0  0            999 V2000
    1.2375   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9520   -1.1270    0.0000 Cu  0  0  0  0  0  0  0  0  0  0  0  0
    2.6664   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D1211

> <DATABASE_NAME>
t3db

> <SMILES>
O[Cu]O

> <INCHI_IDENTIFIER>
InChI=1S/Cu.2H2O/h;2*1H2/q+2;;/p-2

> <INCHI_KEY>
JJLJMEJHUUYSSY-UHFFFAOYSA-L

> <FORMULA>
CuH2O2

> <MOLECULAR_WEIGHT>
97.561

> <EXACT_MASS>
96.935080387

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_AVERAGE_POLARIZABILITY>
4.531787704419845

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
copperdiol

> <JCHEM_LOGP>
-1.8223999999999998

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.899116219602561

> <JCHEM_PKA_STRONGEST_BASIC>
-2.2738560454424137

> <JCHEM_POLAR_SURFACE_AREA>
40.46

> <JCHEM_REFRACTIVITY>
5.1292

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
copperdiol

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D1211

> <NAME>
Copper(II) hydroxide

> <CAS>
20427-59-2

> <SYNONYMS>
Copper dihydroxide; Copper monohydroxide; Copper oxide hydrated; Copper(2+) hydroxide; Copper(I) hydroxide; Criscobre; Cuidrox; Cupravit blau; Cupravit blue; Cupric hydroxide; Cuprous hydroxide; Hydrated copper oxide; Hydrated cupric oxide; Indium hydroxide oxide; Kocide SD; Kuprablau; Parasol; Schweitzer's reagent

> <TYPES>
Inorganic Compound; Pesticide; Copper Compound; Natural Compound

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