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1313-13-9 molecular structure
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manganese(4+) ion dioxidandiide

ChemBase ID: 295174
Molecular Formular: MnO2
Molecular Mass: 86.936849
Monoisotopic Mass: 86.92787434
SMILES and InChIs

SMILES:
[O-2].[O-2].[Mn+4]
Canonical SMILES:
[O-2].[O-2].[Mn+4]
InChI:
InChI=1S/Mn.2O/q+4;2*-2
InChIKey:
GOPYZMJAIPBUGX-UHFFFAOYSA-N

Cite this record

CBID:295174 http://www.chembase.cn/molecule-295174.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
manganese(4+) ion dioxidandiide
IUPAC Traditional name
manganese(4+) ion dioxidandiide
Synonyms
Manganese dioxide
Manganese(IV) oxide
Manganese(IV) oxide, Puratronic®
Manganese peroxide
Manganese(IV) oxide, activated, tech.
Manganese black
Manganese superoxide
二氧化锰(IV)
二氧化锰, Puratronic®
二氧化锰, activated, tech.
CAS Number
1313-13-9
EC Number
215-202-6
MDL Number
MFCD00003463
Merck Index
145730
PubChem SID
180680705
PubChem CID
10197621

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 10197621 external link

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)
Solubility
Insoluble in water, nitric acid, sulfuric acid. Soluble in HCl. In presence of hydrogen peroxide or oxalic acid soluble in dilute HNO3 and H2SO4 expand Show data source
Apperance
-325 Mesh Powder expand Show data source
Powder expand Show data source
Melting Point
535°C dec. expand Show data source
Density
5.026 expand Show data source
RTECS
OP0350000 expand Show data source
European Hazard Symbols
X expand Show data source
Risk Statements
20/22 expand Show data source
Safety Statements
25 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H302-H332 expand Show data source
GHS Precautionary statements
P261-P264-P304+P340-P301+P312-P312-P501A expand Show data source
Purity
98% expand Show data source
99.9% (metals basis) expand Show data source
99.997% (metals basis) expand Show data source
Mn 58% min expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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  • • Mild oxidizing agent. For reviews, see: Synthesis, 65, 133 (1976); J. Prakt. Chem./ Chem. Ztg., 337, 75 (1995). See also M. Hudlicky, Oxidations in Organic Chemistry, ACS Monograph 186, Washington DC (1990).
  • • Widely used for the selective oxidation of allylic and benzylic alcohols to aldehydes or ketones. See, e.g.: Org. Synth. Coll., 7, 102 (1990); 9, 136 (1998).
  • • For use as a co-oxidant, in combination with 1,4-benzoquinone, in the allylic oxidation of olefins, catalyzed by Palladium(II) acetate, 10516, see: Org. Synth. Coll., 8, 5, 137 (1993).
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PATENTS

PATENTS

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INTERNET

INTERNET

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