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13454-89-2 molecular structure
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copper(2+) ion diiodate

ChemBase ID: 109867
Molecular Formular: CuI2O6
Molecular Mass: 413.35134
Monoisotopic Mass: 412.70803122
SMILES and InChIs

SMILES:
[Cu+2].[O-][I](=O)=O.[O-][I](=O)=O
Canonical SMILES:
[O-][I](=O)=O.[O-][I](=O)=O.[Cu+2]
InChI:
InChI=1S/Cu.2HIO3/c;2*2-1(3)4/h;2*(H,2,3,4)/q+2;;/p-2
InChIKey:
LLVVIWYEOKVOFV-UHFFFAOYSA-L

Cite this record

CBID:109867 http://www.chembase.cn/molecule-109867.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
copper(2+) ion diiodate
IUPAC Traditional name
copper(2+) diiodate
copper(2+) ion diiodate
Synonyms
CUPRIC IODATE
Copper iodate, anhydrous
碘酸铜,无水
CAS Number
13454-89-2
MDL Number
MFCD00016055
PubChem SID
162095776
PubChem CID
9801829

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 9801829 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -32.990604  H Acceptors
H Donor LogD (pH = 5.5) -2.1981263 
LogD (pH = 7.4) -2.1981263  Log P 0.17827241 
Molar Refractivity 17.6695 cm3 Polarizability 8.199112 Å3
Polar Surface Area 57.2 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Powder expand Show data source
Melting Point
dec. expand Show data source
Density
5.241^1^5 expand Show data source
Storage Warning
Hygroscopic expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN1479 expand Show data source
MSDS Link
Download expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
II expand Show data source
Risk Statements
8-36/37/38 expand Show data source
Safety Statements
17-26-37-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
GHS Hazard statements
H272-H315-H319-H335 expand Show data source
GHS Precautionary statements
P221-P210-P305+P351+P338-P302+P352-P405-P501A expand Show data source
Purity
95% expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05212835 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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