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12031-80-0 molecular structure
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dilithium(1+) ion dioxidanediide

ChemBase ID: 128087
Molecular Formular: Li2O2
Molecular Mass: 45.8808
Monoisotopic Mass: 46.02183834
SMILES and InChIs

SMILES:
[Li+].[Li+].[O-][O-]
Canonical SMILES:
[O-][O-].[Li+].[Li+]
InChI:
InChI=1S/2Li.O2/c;;1-2/q2*+1;-2
InChIKey:
HPGPEWYJWRWDTP-UHFFFAOYSA-N

Cite this record

CBID:128087 http://www.chembase.cn/molecule-128087.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dilithium(1+) ion dioxidanediide
IUPAC Traditional name
dilithium(1+) ion peroxide
Synonyms
Lithium peroxide
Dilithium peroxide
Lithium (I) peroxide
Lithium peroxide
过氧化锂
CAS Number
12031-80-0
EC Number
234-758-0
MDL Number
MFCD00016184
PubChem SID
24861460
PubChem CID
25489
Chemspider ID
23787
Wikipedia Title
Lithium_peroxide

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 11.520607  H Acceptors
H Donor LogD (pH = 5.5) -0.44720283 
LogD (pH = 7.4) -0.44723517  Log P -0.4472024 
Molar Refractivity 2.8858 cm3 Polarizability 1.6641 Å3
Polar Surface Area 46.12 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
insoluble in alcohol expand Show data source
soluble in water expand Show data source
Apperance
fine, white powder expand Show data source
powder expand Show data source
Powder expand Show data source
Melting Point
195 °C expand Show data source
Boiling Point
Decomposes to Li2O expand Show data source
Density
2.31 g/cm3 expand Show data source
Odor
odorless expand Show data source
Std enthalpy of formation
-13.82 kJ/g expand Show data source
Storage Warning
Air & Moisture Sensitive expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Oxidising Oxidising (O) expand Show data source
UN Number
1472 expand Show data source
UN1472 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
8-34 expand Show data source
8-35 expand Show data source
Safety Statements
8-26-27-28-36/37/39-45 expand Show data source
8-27-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
NFPA704
NFPA 704 diagram
0
3
2
OX
expand Show data source
GHS Hazard statements
H272-H314 expand Show data source
H272-H314-H318 expand Show data source
GHS Precautionary statements
P220-P280-P305 + P351 + P338-P310 expand Show data source
P221-P210-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 1472 5.1/PG 2 expand Show data source
Purity
90% expand Show data source
90% min expand Show data source
Grade
technical grade expand Show data source
Empirical Formula (Hill Notation)
Li2O2 expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 347043 external link
Packaging
50 g in poly bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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