Mrv0541 08251413502D          

  6  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
    2.2393    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4786    0.0000    0.0000 O   0  0  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 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.1214   -1.6500    0.0000 Zn  0  2  0  0  0  0  0  0  0  0  0  0
M  CHG  3   4  -1   5  -1   6   2
M  END
> <DATABASE_ID>
T3D0713

> <DATABASE_NAME>
t3db

> <SMILES>
O.O.[OH-].[OH-].[Cr].[Zn++]

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

> <INCHI_KEY>
LFMDYAPVRKGSEN-UHFFFAOYSA-L

> <FORMULA>
CrH6O4Zn

> <MOLECULAR_WEIGHT>
187.45

> <EXACT_MASS>
185.896267162

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
zinc(2+) ion chromium dihydrate dihydroxide

> <ALOGPS_LOGP>
-1.27

> <JCHEM_LOGP>
-0.156

> <ALOGPS_LOGS>
1.00

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.00e+03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
zinc(2+) ion chromium dihydrate dihydroxide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D0713

> <NAME>
Zinc chromate

> <CAS>
13530-65-9

> <SYNONYMS>
Basic zinc chromate; Buttercup yellow; C.I. Pigment Yellow 36; Pigment Yellow 36; Potassium zinc chromate yellow; Zinc chromate am; Zinc chromate c; Zinc chromate o; Zinc chromate t; Zinc chromate z; Zinc chromate(VI) hydroxide; Zinc chrome; Zinc chrome (anti-corrosion); Zinc chrome yellow; Zinc chromic acid; Zinc chromium oxide (ZnCrO4); Zinc hydroxychromate; Zinc tetraoxychromate; Zinc tetraoxychromate 76A; Zinc tetraoxychromate 780B; Zinc tetroxychromate; Zinc yellow; Zinc Yellow 1007; Zincro zto; ZnCrO4; ZTO

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

$$$$