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12017-01-5 molecular structure
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titanium(4+) ion λ2-cobalt(2+) ion trioxidandiide

ChemBase ID: 303608
Molecular Formular: CoO3Ti
Molecular Mass: 154.7984
Monoisotopic Mass: 154.86588516
SMILES and InChIs

SMILES:
[O-2].[O-2].[O-2].[Ti+4].[Co+2]
Canonical SMILES:
[O-2].[O-2].[O-2].[Ti+4].[Co+2]
InChI:
InChI=1S/Co.3O.Ti/q+2;3*-2;+4
InChIKey:
LFSBSHDDAGNCTM-UHFFFAOYSA-N

Cite this record

CBID:303608 http://www.chembase.cn/molecule-303608.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
titanium(4+) ion λ2-cobalt(2+) ion trioxidandiide
IUPAC Traditional name
titanium(4+) ion λ2-cobalt(2+) ion trioxidandiide
Synonyms
Cobalt titanate
Cobalt titanium oxide
钛酸钴
CAS Number
12017-01-5
EC Number
234-615-2
MDL Number
MFCD00016022

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar 41670 external link Add to cart
Data Source Data ID Price
Alfa Aesar
41670 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 15.7  H Acceptors
H Donor LogD (pH = 5.5) -0.652 
LogD (pH = 7.4) -0.652  Log P -0.652 
Molar Refractivity 13.1149 cm3 Polarizability 1.8190874 Å3
Polar Surface Area 0.0 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
-325 Mesh Powder expand Show data source
European Hazard Symbols
X expand Show data source
Risk Statements
36/37/38-42/43 expand Show data source
Safety Statements
23-24-26-37-45-60 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
H334-H315-H319-H317-H335 expand Show data source
GHS Precautionary statements
P285-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Purity
99.8% (metals basis excluding Ni), Ni <0.15% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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