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12035-38-0 molecular structure
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nickel(2+) ion oxostannanebis(olate) dihydrate

ChemBase ID: 303381
Molecular Formular: H4NiO5Sn
Molecular Mass: 261.42316
Monoisotopic Mass: 261.84341013
SMILES and InChIs

SMILES:
O.O.[O-][Sn](=O)[O-].[Ni+2]
Canonical SMILES:
[O-][Sn](=O)[O-].O.O.[Ni+2]
InChI:
InChI=1S/Ni.2H2O.3O.Sn/h;2*1H2;;;;/q+2;;;;2*-1;
InChIKey:
QEGXCMDMJSMOBZ-UHFFFAOYSA-N

Cite this record

CBID:303381 http://www.chembase.cn/molecule-303381.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
nickel(2+) ion oxostannanebis(olate) dihydrate
IUPAC Traditional name
nickel(2+) ion oxostannanebis(olate) dihydrate
Synonyms
Nickel stannate
Nickel tin oxide dihydrate
锡酸镍二水合物
CAS Number
12035-38-0
EC Number
234-824-9
MDL Number
MFCD00054011

DATA SOURCES

DATA SOURCES

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Data Source Data ID
Alfa Aesar 39452 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 2.69897  H Acceptors
H Donor LogD (pH = 5.5) -4.0782948 
LogD (pH = 7.4) -4.2371097  Log P -1.9238 
Molar Refractivity 4.3287 cm3 Polarizability 7.7500906 Å3
Polar Surface Area 63.19 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Apperance
Powder expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
Risk Statements
49-43-48/23 expand Show data source
Safety Statements
53-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS08 expand Show data source
GHS Hazard statements
H350-H372-H317 expand Show data source
GHS Precautionary statements
P260-P261-P302+P352-P321-P405-P501A expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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