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12018-18-7 molecular structure
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nickel(2+) ion dioxodichromium-1,2-bis(olate)

ChemBase ID: 303081
Molecular Formular: Cr2NiO4
Molecular Mass: 226.6832
Monoisotopic Mass: 225.79601638
SMILES and InChIs

SMILES:
[O-][Cr](=O)[Cr](=O)[O-].[Ni+2]
Canonical SMILES:
[O-][Cr](=O)[Cr](=O)[O-].[Ni+2]
InChI:
InChI=1S/2Cr.Ni.4O/q;;+2;;;2*-1
InChIKey:
SMFKXCAVXCXXDR-UHFFFAOYSA-N

Cite this record

CBID:303081 http://www.chembase.cn/molecule-303081.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
nickel(2+) ion dioxodichromium-1,2-bis(olate)
IUPAC Traditional name
nickel(2+) ion dioxodichromium-1,2-bis(olate)
Synonyms
Nickel chromite
亚铬酸镍
CAS Number
12018-18-7
EC Number
234-636-7
MDL Number
MFCD00064806

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar 19424 external link Add to cart
Data Source Data ID Price
Alfa Aesar
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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) -7.407955 
LogD (pH = 7.4) -7.79651  Log P -3.2752 
Molar Refractivity 5.7716 cm3 Polarizability 9.253985 Å3
Polar Surface Area 80.26 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Apperance
-100 Mesh Powder expand Show data source
RTECS
GB9000000 expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
Risk Statements
49-43 expand Show data source
Safety Statements
53-24-37-45 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-H317 expand Show data source
GHS Precautionary statements
P261-P280-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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